Details
Stereochemistry | RACEMIC |
Molecular Formula | C12H17ClO2 |
Molecular Weight | 228.715 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(C)(O)CC(C)(O)C1=CC=C(Cl)C=C1
InChI
InChIKey=SNJDSTGQYRTZJT-UHFFFAOYSA-N
InChI=1S/C12H17ClO2/c1-11(2,14)8-12(3,15)9-4-6-10(13)7-5-9/h4-7,14-15H,8H2,1-3H3
Molecular Formula | C12H17ClO2 |
Molecular Weight | 228.715 |
Charge | 0 |
Count |
|
Stereochemistry | RACEMIC |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Optical Activity | ( + / - ) |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 16:36:53 UTC 2023
by
admin
on
Fri Dec 15 16:36:53 UTC 2023
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Record UNII |
BLO7300903
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Record Status |
Validated (UNII)
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Record Version |
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-
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Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C265
Created by
admin on Fri Dec 15 16:36:54 UTC 2023 , Edited by admin on Fri Dec 15 16:36:54 UTC 2023
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Code System | Code | Type | Description | ||
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Fenpentadiol
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C004997
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15687-18-0
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239-782-5
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100000081483
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SUB07585MIG
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CHEMBL2106273
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admin on Fri Dec 15 16:36:54 UTC 2023 , Edited by admin on Fri Dec 15 16:36:54 UTC 2023
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1158
Created by
admin on Fri Dec 15 16:36:54 UTC 2023 , Edited by admin on Fri Dec 15 16:36:54 UTC 2023
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DTXSID9023047
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admin on Fri Dec 15 16:36:54 UTC 2023 , Edited by admin on Fri Dec 15 16:36:54 UTC 2023
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m730
Created by
admin on Fri Dec 15 16:36:54 UTC 2023 , Edited by admin on Fri Dec 15 16:36:54 UTC 2023
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PRIMARY | Merck Index | ||
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2006
Created by
admin on Fri Dec 15 16:36:54 UTC 2023 , Edited by admin on Fri Dec 15 16:36:54 UTC 2023
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85896
Created by
admin on Fri Dec 15 16:36:54 UTC 2023 , Edited by admin on Fri Dec 15 16:36:54 UTC 2023
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C65664
Created by
admin on Fri Dec 15 16:36:54 UTC 2023 , Edited by admin on Fri Dec 15 16:36:54 UTC 2023
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BLO7300903
Created by
admin on Fri Dec 15 16:36:54 UTC 2023 , Edited by admin on Fri Dec 15 16:36:54 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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ENANTIOMER -> RACEMATE | |||
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ENANTIOMER -> RACEMATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |