Substances (GSRS)

2-Chloroadamantane

Also: Tricyclo[3.3.1.1<sup>3,7</sup>]decane, 2-chloro-

chemicalUNII D4LK2P9ZZK
Open FDA's page for this record
Substance class
chemical
Definition type
PRIMARY
Definition level
COMPLETE
Uuid
6387840e-6212-433a-8dc3-f33274e675d9
Version
8
UNII
D4LK2P9ZZK
Codes
  1. Uuid
    2add146f-7603-43d3-9d24-5559dc7c44d3
    Code
    123251
    Type
    PRIMARY
    Url
    https://pubchem.ncbi.nlm.nih.gov/compound/123251
    Code system
    PUBCHEM
    References
    0e4a326d-208b-4850-94f4-9dacef5ac5a5
  2. Uuid
    35af4c31-3f2e-4fc5-bd3d-9bddb3b83811
    Code
    7346-41-0
    Type
    PRIMARY
    Url
    https://commonchemistry.cas.org/detail?cas_rn=7346-41-0
    Code system
    CAS
    References
    0e4a326d-208b-4850-94f4-9dacef5ac5a5, f60346c3-01ce-4aef-b74e-dd81d2fe3c0e
  3. Uuid
    e922896e-28aa-42fd-8ddd-2e3b1cd00656
    Code
    230-868-8
    Type
    PRIMARY
    Url
    https://echa.europa.eu/substance-information/-/substanceinfo/100.028.062
    Code system
    ECHA (EC/EINECS)
    References
    0e4a326d-208b-4850-94f4-9dacef5ac5a5
  4. Uuid
    14ace673-f503-1c03-1952-5d2683a3cb0d
    Code
    DTXSID00223676
    Type
    PRIMARY
    Url
    https://comptox.epa.gov/dashboard/chemical/details/DTXSID00223676
    Code system
    EPA CompTox
    References
    0a583c35-f4b0-3932-8ff2-90086a49a7d1
  5. Uuid
    88d33e95-940d-49dc-95b7-0b23feeb5a87
    Code
    D4LK2P9ZZK
    Type
    PRIMARY
    Code system
    FDA UNII
Names
  1. Uuid
    daedf040-3782-4bbd-9260-5fcacf6a634c
    Name
    2-Chloroadamantane
    StdName
    2-CHLOROADAMANTANE
    Type
    cn
    Preferred
    false
    Display name
    true
    Languages
    en
    References
    f60346c3-01ce-4aef-b74e-dd81d2fe3c0e
  2. Uuid
    3d5f36f9-9605-4fe6-95ee-7d0ba74895ea
    Name
    Tricyclo[3.3.1.1<sup>3,7</sup>]decane, 2-chloro-
    StdName
    TRICYCLO(3.3.1.13,7)DECANE, 2-CHLORO-
    Type
    sys
    Preferred
    false
    Display name
    false
    Languages
    en
    References
    587de6a9-79ca-4b18-b32a-aaba37a772da, 5f0188f5-d8a2-4a1a-aeec-90a3dc06a700
References
  1. Uuid
    5f0188f5-d8a2-4a1a-aeec-90a3dc06a700
    Citation
    CHEMID
    Doc type
    SRS
    Public domain
    true
    Tags
    NOMEN
  2. Uuid
    587de6a9-79ca-4b18-b32a-aaba37a772da
    Citation
    EPA
    Doc type
    EPA
    Public domain
    true
    Tags
    NOMEN
  3. Uuid
    0e4a326d-208b-4850-94f4-9dacef5ac5a5
    Citation
    SRS CODE IMPORT
    Doc type
    SRS
    Public domain
    true
    Document date
    1493393760000
    Tags
    NOMEN
  4. Uuid
    0a583c35-f4b0-3932-8ff2-90086a49a7d1
    Citation
    WEBSITE
    Url
    https://comptox.epa.gov/dashboard/dsstoxdb/results?utf8=%E2%9C%93&search=7346-41-0
    Doc type
    WEBSITE
    Public domain
    true
    Tags
    NOMEN, PUBLIC_DOMAIN_RELEASE
  5. Uuid
    f60346c3-01ce-4aef-b74e-dd81d2fe3c0e
    Citation
    STN
    Doc type
    STN (SCIFINDER)
    Public domain
    true
Moieties
  1. Uuid
    8a9915fd-8692-4f4c-a4bb-6679426cab93
    ID
    8a9915fd-8692-4f4c-a4bb-6679426cab93
    Smiles
    C1C2CC3CC1CC(C2)C3Cl
    Formula
    C10H15Cl
    Atropisomerism
    No
    Charge
    0
    Count
    1
    Stereochemistry
    ACHIRAL
    Defined stereo
    0
    Ez centers
    0
    Molecular weight
    170.6794
    Optical activity
    NONE
    Stereo centers
    0
    Molfile

    Marvin 01132107122D 11 13 0 0 0 0 999 V2000 2.5125 0.2319 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.7173 0.0231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8810 0.2319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 0.0231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -0.8135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3318 -1.5247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4624 -1.3156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4624 -0.4790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2993 -1.5247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7173 -0.8135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8810 -1.0228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 3 2 1 0 0 0 0 2 10 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 6 5 1 0 0 0 0 5 11 1 0 0 0 0 7 6 1 0 0 0 0 8 7 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 11 10 1 0 0 0 0 M END

    Count amount
    Type
    MOL RATIO
    Average
    1
    Units
    MOL RATIO
    Uuid
    e328453c-08dd-44fc-bc94-fc9a3c574359
Structure
ID
7a4f4d0f-4949-4b95-906b-0814d33b79ec
Smiles
C1C2CC3CC1CC(C2)C3Cl
Formula
C10H15Cl
Atropisomerism
No
Charge
0
Count
1
Stereochemistry
ACHIRAL
Defined stereo
0
Ez centers
0
Molecular weight
170.6794
Optical activity
NONE
Stereo centers
5
Molfile

JSDraw205112314582D 11 13 0 0 0 0 0 V2000 25.3477 -9.0402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.1147 -7.6817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.3211 -6.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.5433 -6.7951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.5523 -7.6960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.3371 -8.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.7765 -8.1536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.9900 -7.7122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.7854 -9.0545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.7605 -6.3517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.3460 -7.6698 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 2 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 7 1 0 0 0 0 8 9 1 0 0 0 0 9 1 1 0 0 0 0 10 8 1 0 0 0 0 3 10 1 0 0 0 0 11 2 1 0 0 0 0 M END

References
5f0188f5-d8a2-4a1a-aeec-90a3dc06a700
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Data from openFDA, FDA's public API. FDA says not to rely on it to make decisions about medical care and to treat every result as unvalidated; confirm against FDA's own record and the product labeling. Not medical or legal advice.