Substances (GSRS)

1-CYCLOHEXANECARBOXALDEHYDE

Also: 1-FORMYLCYCLOHEXANE, CYCLOHEXANAL, CYCLOHEXANALDEHYDE +11

chemicalUNII SW0X317TE3
Open FDA's page for this record
Substance class
chemical
Definition type
PRIMARY
Definition level
COMPLETE
Uuid
af98fa7b-c4a4-471a-9d16-3fa89c101209
Version
6
UNII
SW0X317TE3
Codes
  1. Uuid
    5f83211e-e3e0-4882-a3dd-688d3f711deb
    Code
    2043-61-0
    Type
    PRIMARY
    Url
    https://commonchemistry.cas.org/detail?cas_rn=2043-61-0
    Code system
    CAS
    References
    cab89809-0b60-4d11-9bac-874f5a8be05a, 25b66eef-1393-43f5-b089-30030daebc80
  2. Uuid
    a0de42d7-3dee-45dd-9a5a-cbf00df3ac2b
    Code
    218-057-7
    Type
    PRIMARY
    Url
    https://echa.europa.eu/substance-information/-/substanceinfo/100.016.417
    Code system
    ECHA (EC/EINECS)
    References
    cab89809-0b60-4d11-9bac-874f5a8be05a
  3. Uuid
    3226ab56-3c23-46dd-b490-13093c910929
    Code
    16275
    Type
    PRIMARY
    Url
    https://pubchem.ncbi.nlm.nih.gov/compound/16275
    Code system
    PUBCHEM
    References
    cab89809-0b60-4d11-9bac-874f5a8be05a
  4. Uuid
    2fdded99-963e-355a-612e-ba213b980e6d
    Code
    DTXSID40174375
    Type
    PRIMARY
    Url
    https://comptox.epa.gov/dashboard/chemical/details/DTXSID40174375
    Code system
    EPA CompTox
    References
    269460bd-f3b9-ca95-6a06-20c7a9416f34
  5. Uuid
    d822f71c-25e8-4e55-81c4-384f950a93e6
    Code
    SW0X317TE3
    Type
    PRIMARY
    Code system
    FDA UNII
  6. Uuid
    4a21386d-607d-17dc-0a42-de860ca53dab
    Code
    68509
    Type
    PRIMARY
    Url
    https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=68509
    Code system
    NSC
    References
    2465f829-2832-dc15-8408-3dc36fe29f7c
Names
  1. Uuid
    3dfce845-211e-44ab-8943-d8a51866bcdb
    Name
    1-CYCLOHEXANECARBOXALDEHYDE
    StdName
    1-CYCLOHEXANECARBOXALDEHYDE
    Type
    sys
    Preferred
    false
    Display name
    false
    Languages
    en
    References
    31408ca0-4d9f-4aae-859d-9133a181c4f5, 5a13dba2-afb5-4972-879a-02d2820efedd
  2. Uuid
    da364c23-6714-477e-b790-0875bde4f3eb
    Name
    1-FORMYLCYCLOHEXANE
    StdName
    1-FORMYLCYCLOHEXANE
    Type
    sys
    Preferred
    false
    Display name
    false
    Languages
    en
    References
    31408ca0-4d9f-4aae-859d-9133a181c4f5, 5a13dba2-afb5-4972-879a-02d2820efedd
  3. Uuid
    25cd942b-0267-40fa-9210-c8cf514b7b11
    Name
    CYCLOHEXANAL
    StdName
    CYCLOHEXANAL
    Type
    sys
    Preferred
    false
    Display name
    false
    Languages
    en
    References
    31408ca0-4d9f-4aae-859d-9133a181c4f5, 5a13dba2-afb5-4972-879a-02d2820efedd
  4. Uuid
    ae9b289d-57b1-45de-bf32-cdb0940a2517
    Name
    CYCLOHEXANALDEHYDE
    StdName
    CYCLOHEXANALDEHYDE
    Type
    sys
    Preferred
    false
    Display name
    false
    Languages
    en
    References
    31408ca0-4d9f-4aae-859d-9133a181c4f5, 5a13dba2-afb5-4972-879a-02d2820efedd
  5. Uuid
    d9961624-d875-400a-90a3-cfa388a5de30
    Name
    CYCLOHEXANCARBOXALDEHYDE
    StdName
    CYCLOHEXANCARBOXALDEHYDE
    Type
    sys
    Preferred
    false
    Display name
    false
    Languages
    en
    References
    31408ca0-4d9f-4aae-859d-9133a181c4f5, 5a13dba2-afb5-4972-879a-02d2820efedd
  6. Uuid
    06053c21-56ba-4bef-9138-017cec3c91b5
    Name
    CYCLOHEXANE-1-ALDEHYDE
    StdName
    CYCLOHEXANE-1-ALDEHYDE
    Type
    sys
    Preferred
    false
    Display name
    false
    Languages
    en
    References
    31408ca0-4d9f-4aae-859d-9133a181c4f5, 5a13dba2-afb5-4972-879a-02d2820efedd
  7. Uuid
    fce1666a-3e73-4169-bc34-acf855926bb9
    Name
    CYCLOHEXANEALDEHYDE
    StdName
    CYCLOHEXANEALDEHYDE
    Type
    sys
    Preferred
    false
    Display name
    false
    Languages
    en
    References
    31408ca0-4d9f-4aae-859d-9133a181c4f5, 5a13dba2-afb5-4972-879a-02d2820efedd
  8. Uuid
    64ba15c3-4bbb-4a18-a0fa-ea6f943ba1c5
    Name
    CYCLOHEXANECARBALDEHYDE
    StdName
    CYCLOHEXANECARBALDEHYDE
    Type
    sys
    Preferred
    false
    Display name
    false
    Languages
    en
    References
    31408ca0-4d9f-4aae-859d-9133a181c4f5, 5a13dba2-afb5-4972-879a-02d2820efedd
  9. Uuid
    657fae66-df7f-45b7-be22-5c50a528814f
    Name
    CYCLOHEXANECARBOXALDEHYDE
    StdName
    CYCLOHEXANECARBOXALDEHYDE
    Type
    sys
    Preferred
    false
    Display name
    true
    Languages
    en
    References
    d2ae8fcf-e2bf-4981-bdad-bc18bdaedd61
  10. Uuid
    b15834c3-b2cc-4579-a72e-b14a7ca5e9bb
    Name
    CYCLOHEXYLCARBALDEHYDE
    StdName
    CYCLOHEXYLCARBALDEHYDE
    Type
    cn
    Preferred
    false
    Display name
    false
    Languages
    en
    References
    31408ca0-4d9f-4aae-859d-9133a181c4f5, 5a13dba2-afb5-4972-879a-02d2820efedd
  11. Uuid
    d712c62c-00aa-4d64-a6ba-ed52a728df46
    Name
    CYCLOHEXYLCARBOXALDEHYDE
    StdName
    CYCLOHEXYLCARBOXALDEHYDE
    Type
    cn
    Preferred
    false
    Display name
    false
    Languages
    en
    References
    31408ca0-4d9f-4aae-859d-9133a181c4f5, 5a13dba2-afb5-4972-879a-02d2820efedd
  12. Uuid
    b0f26fa1-f1e0-45ea-8df2-b6fa2b4f9fbc
    Name
    CYCLOHEXYLFORMALDEHYDE
    StdName
    CYCLOHEXYLFORMALDEHYDE
    Type
    sys
    Preferred
    false
    Display name
    false
    Languages
    en
    References
    31408ca0-4d9f-4aae-859d-9133a181c4f5, 5a13dba2-afb5-4972-879a-02d2820efedd
  13. +3 more not shown
References
  1. Uuid
    d2ae8fcf-e2bf-4981-bdad-bc18bdaedd61
    Citation
    CHEMID 2011
    Doc type
    SRS
    Public domain
    true
    Tags
    NOMEN, PUBLIC_DOMAIN_RELEASE
  2. Uuid
    31408ca0-4d9f-4aae-859d-9133a181c4f5
    Citation
    STN
    Doc type
    SRS
    Public domain
    true
    Tags
    NOMEN
  3. Uuid
    5a13dba2-afb5-4972-879a-02d2820efedd
    Citation
    STN (SCIFINDER)
    Doc type
    STN (SCIFINDER)
    Public domain
    true
    Tags
    NOMEN
  4. Uuid
    cab89809-0b60-4d11-9bac-874f5a8be05a
    Citation
    SRS CODE IMPORT
    Doc type
    SRS
    Public domain
    true
    Document date
    1493391081000
    Tags
    NOMEN
  5. Uuid
    e05a0ec2-b7fd-46b5-a92b-8325f984f240
    Citation
    CHEMID 2011
    Doc type
    SRS
    Public domain
    true
    Tags
    NOMEN
  6. Uuid
    269460bd-f3b9-ca95-6a06-20c7a9416f34
    Citation
    WEBSITE
    Url
    https://comptox.epa.gov/dashboard/dsstoxdb/results?utf8=%E2%9C%93&search=2043-61-0
    Doc type
    WEBSITE
    Public domain
    true
    Tags
    NOMEN, PUBLIC_DOMAIN_RELEASE
  7. Uuid
    2465f829-2832-dc15-8408-3dc36fe29f7c
    Citation
    NCI
    Doc type
    NCI DRUG DICTIONARY
    Public domain
    true
  8. Uuid
    25b66eef-1393-43f5-b089-30030daebc80
    Citation
    STN
    Doc type
    STN (SCIFINDER)
    Public domain
    true
Moieties
  1. Uuid
    50a37225-af90-421b-b85a-3ffbdf3412c5
    ID
    50a37225-af90-421b-b85a-3ffbdf3412c5
    Smiles
    C1CCC(CC1)C=O
    Formula
    C7H12O
    Atropisomerism
    No
    Charge
    0
    Count
    1
    Stereochemistry
    ACHIRAL
    Defined stereo
    0
    Ez centers
    0
    Molecular weight
    112.1698
    Optical activity
    NONE
    Stereo centers
    0
    Molfile

    Marvin 01132104122D 8 8 0 0 0 0 999 V2000 8.3810 -4.6581 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6397 -4.2986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9299 -4.7080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2136 -4.2986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5012 -4.7080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5012 -5.5358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2136 -5.9504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9299 -5.5358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 2 0 0 0 0 3 2 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 7 6 1 0 0 0 0 8 7 1 0 0 0 0 M END

    Count amount
    Type
    MOL RATIO
    Average
    1
    Units
    MOL RATIO
    Uuid
    3a6bb51c-f505-4ac6-b2ca-01bf5b6f81d5
Structure
ID
d2873fe1-ab98-4d21-a44e-1ffb579428fb
Smiles
C1CCC(CC1)C=O
Formula
C7H12O
Atropisomerism
No
Charge
0
Count
1
Stereochemistry
ACHIRAL
Defined stereo
0
Ez centers
0
Molecular weight
112.1698
Optical activity
NONE
Stereo centers
0
Molfile

Marvin 01132110532D 8 8 0 0 0 0 999 V2000 6.9299 -4.7080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2136 -4.2986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5012 -4.7080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5012 -5.5358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2136 -5.9504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9299 -5.5358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6397 -4.2986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3810 -4.6581 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 5 4 1 0 0 0 0 6 5 1 0 0 0 0 1 6 1 0 0 0 0 1 7 1 0 0 0 0 7 8 2 0 0 0 0 M END

References
e05a0ec2-b7fd-46b5-a92b-8325f984f240
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