| Identification | Back Directory | [Name]
1-Cyanocyclohexaneacetic acid | [CAS]
133481-09-1 | [Synonyms]
Gabapentin USP RC B
Gabapentin IMpurity B
Gabapentin EP Impurity B
Gabapentin Related Material B
1-cyanocyclohexaneacetic acid
(1-cyanocyclohexyl)acetic acid
Cyclohexaneacetic acid,1-cyano-
2-(1-Cyanocyclohexyl)acetic acid
GABAPENTIN RELATED COMPOUND B (30 MG) ((1-CYANOCYCLOHEXYL)ACETIC ACID) | [Molecular Formula]
C9H13NO2 | [MDL Number]
MFCD04117948 | [MOL File]
133481-09-1.mol | [Molecular Weight]
167.21 |
| Chemical Properties | Back Directory | [Appearance]
White Solid | [Melting point ]
98-100°C | [Boiling point ]
356.6±15.0 °C(Predicted) | [density ]
1.13±0.1 g/cm3(Predicted) | [storage temp. ]
-20°C Freezer | [solubility ]
Chloroform (Slightly), Methanol (Slightly) | [form ]
neat | [pka]
4.72±0.10(Predicted) | [BRN ]
11150802 | [Major Application]
pharmaceutical | [InChI]
1S/C9H13NO2/c10-7-9(6-8(11)12)4-2-1-3-5-9/h1-6H2,(H,11,12) | [InChIKey]
YGFXLCAKCKPSQQ-UHFFFAOYSA-N | [SMILES]
OC(=O)CC1(CCCCC1)C#N |
| Safety Data | Back Directory | [Hazard Codes ]
Xi | [Risk Statements ]
22 | [WGK Germany ]
WGK 3 | [HS Code ]
2926900005 | [Storage Class]
11 - Combustible Solids | [Hazard Classifications]
Acute Tox. 4 Oral
Aquatic Chronic 3 |
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