ChemicalBook--->CAS DataBase List--->25912-50-9

25912-50-9

25912-50-9 Structure

25912-50-9 Structure
IdentificationMore
[Name]

3-Aminocyclohexanecarboxylic acid
[CAS]

25912-50-9
[Synonyms]

3-AMINOCYCLOHEXANECARBOXYLIC ACID
3-AMINOCYCLOHEXANECARBOXYLIC ACID 95+%
3-Aminocyclohexanecarboxylic Acid (cis-and trans-mixture)
[Molecular Formula]

C7H13NO2
[MDL Number]

MFCD00059562
[Molecular Weight]

143.18
[MOL File]

25912-50-9.mol
Chemical PropertiesBack Directory
[Melting point ]

285 °C
[Boiling point ]

280.0±33.0 °C(Predicted)
[density ]

1.133±0.06 g/cm3(Predicted)
[storage temp. ]

Keep in dark place,Sealed in dry,Room Temperature
[Water Solubility ]

Soluble in water
[form ]

powder to crystal
[pka]

4.23±0.13(Predicted)
[color ]

White to Almost white
[InChI]

InChI=1S/C7H13NO2/c8-6-3-1-2-5(4-6)7(9)10/h5-6H,1-4,8H2,(H,9,10)
[InChIKey]

CKTUXQBZPWBFDX-UHFFFAOYSA-N
[SMILES]

C1(C(O)=O)CCCC(N)C1
[CAS DataBase Reference]

25912-50-9(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Corrosion (GHS05)
GHS05
[Signal word ]

Warning
[Hazard statements ]

H314
[Precautionary statements ]

P264b-P271-P280-P301+P330+P331-P304+P340-P305+P351+P338-P310-P363-P403+P233-P501c
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
[Hazard Note ]

Irritant
[HS Code ]

2916399090
Hazard InformationBack Directory
[Uses]

3-Aminocyclohexanecarboxylic Acid is an intermediate used to prepare PF-04449913 as potent and orally bioavailable Smoothened inhibitor and potential antitumor. It is also used in the synthesis of functionalized glutaramides as selective inhibitors of neutral endopeptidase for the treatment of female sexual arousal disorder.
Spectrum DetailBack Directory
[Spectrum Detail]

3-Aminocyclohexanecarboxylic acid(25912-50-9)MS
3-Aminocyclohexanecarboxylic acid(25912-50-9)1HNMR
Well-known Reagent Company Product InformationBack Directory
[TCI AMERICA]

3-Aminocyclohexanecarboxylic Acid  (cis-and trans-mixture),>95.0%(T)(25912-50-9)
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