ChemicalBook--->CAS DataBase List--->943-29-3

943-29-3

943-29-3 Structure

943-29-3 Structure
IdentificationBack Directory
[Name]

trans-4-tert-Butylcyclohexanecarboxylic acid
[CAS]

943-29-3
[Synonyms]

trans-4-tert-Butylcy
4-TERT-BUTYCYCLOHEXANECARBOXYLIC ACID
(1β)-4α-tert-Butylcyclohexanecarboxylic acid
TRANS-4-TERT-BUTYLCYCLOHEXANECARBOXYLIC ACID
4-TERT-BUTYLCYCLOHEXANECARBOXYLIC ACID (TRANS)
(1α,4β)-4-tert-Butylcyclohexanecarboxylic acid
trans-4-tert-Butylcyclohexanecarboxylic acid,97%
(1r,4r)-4-(tert-butyl)cyclohexanecarboxylic acid
Cyclohexanecarboxylic acid, 4-tert-butyl-, trans-
trans-4-tert-Butylcyclohexanecarboxylic acid, 97% 5GR
trans-4-tert-Butylcyclohexanecarboxylic Acid
[Molecular Formula]

C11H20O2
[MDL Number]

MFCD00466237
[MOL File]

943-29-3.mol
[Molecular Weight]

184.28
Chemical PropertiesBack Directory
[Appearance]

white fine crystalline powder
[Melting point ]

170-175 °C
[Boiling point ]

282.9±8.0 °C(Predicted)
[density ]

0.996±0.06 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Room Temperature
[form ]

powder to crystal
[pka]

4.92±0.10(Predicted)
[color ]

White to Almost white
[InChI]

InChI=1S/C11H20O2/c1-11(2,3)9-6-4-8(5-7-9)10(12)13/h8-9H,4-7H2,1-3H3,(H,12,13)/t8-,9-
[InChIKey]

QVQKEGYITJBHRQ-KYZUINATSA-N
[SMILES]

[C@@H]1(C(O)=O)CC[C@@H](C(C)(C)C)CC1
[CAS DataBase Reference]

943-29-3
[NIST Chemistry Reference]

Cyclohexanecarboxylic acid, 4-(1,1-dimethylethyl)-, trans-(943-29-3)
Hazard InformationBack Directory
[Chemical Properties]

white fine crystalline powder
[Definition]

ChEBI: Trans-4-tert-butylcyclohexanecarboxylic acid is a monocarboxylic acid that is cyclohexanecarboxylic acid substituted by a tert-butyl group at position 4 (the trans-stereoisomer). It has a role as a metabolite. It derives from a hydride of a cyclohexane.
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

37/39-26
[HS Code ]

29162000
Spectrum DetailBack Directory
[Spectrum Detail]

trans-4-tert-Butylcyclohexanecarboxylic acid(943-29-3)MS
trans-4-tert-Butylcyclohexanecarboxylic acid(943-29-3)1HNMR
trans-4-tert-Butylcyclohexanecarboxylic acid(943-29-3)13CNMR
trans-4-tert-Butylcyclohexanecarboxylic acid(943-29-3)IR1
trans-4-tert-Butylcyclohexanecarboxylic acid(943-29-3)IR2
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