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943-29-3

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Basic Information
CAS No.: 943-29-3
Name: trans-4-tert-Butylcyclohexanecarboxylic acid
Article Data: 32
Molecular Structure:
Molecular Structure of 943-29-3 (trans-4-tert-Butylcyclohexanecarboxylic acid)
Formula: C11H20O2
Molecular Weight: 184.279
Synonyms: Cyclohexanecarboxylicacid, 4-tert-butyl-, trans- (8CI);trans-4-tert-Butyl-1-cyclohexanecarboxylicacid;trans-4-tert-Butylcyclohexanoic acid;
Density: 0.996 g/cm3
Melting Point: 170-175 °C
Boiling Point: 282.9 °C at 760 mmHg
Flash Point: 136.7 °C
Appearance: white fine crystalline powder
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 37/39-26
PSA: 37.30000
LogP: 2.92350
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Chemistry

Molecular Structure of Trans-4-tert-Butylcyclohexanecarboxylic acid (CAS No.943-29-3):

Molecular Formula: C11H20O2 
Molecular Weight: 184.2753
CAS No: 943-29-3
H bond acceptors: 2
H bond donors: 1
Freely Rotating Bonds: 2
Polar Surface Area: 26.3 Å2
Index of Refraction: 1.473
Molar Refractivity: 51.97 cm3
Molar Volume: 184.9 cm3
Surface Tension: 36.7 dyne/cm
Density: 0.996 g/cm3
Flash Point: 136.7 °C
Enthalpy of Vaporization: 57.42 kJ/mol
Boiling Point: 282.9 °C at 760 mmHg
Vapour Pressure: 0.000852 mmHg at 25°C
InChI: InChI=1/C11H20O2/c1-11(2,3)9-6-4-8(5-7-9)10(12)13/h8-9H,4-7H2,1-3H3,(H,12,13)
InChIKey: QVQKEGYITJBHRQ-UHFFFAOYAR
Std. 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)
Std. InChIKey: QVQKEGYITJBHRQ-UHFFFAOYSA-N
IUPAC Name: 4-Tert-butylcyclohexane-1-carboxylic acid 
Product Categories: Biphenyl & Diphenyl ether;4-Substituted Cyclohexanecarboxylic Acids

Safety Profile

Hazard Codes: IrritantXi
Risk Statements: 36/37/38
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 37/39-26 
S37/39:Wear suitable gloves and eye/face protection. 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

Specification

  Trans-4-tert-Butylcyclohexanecarboxylic acid (CAS No.943-29-3), its synonyms are Cyclohexanecarboxylic acid, 4-(1,1-dimethylethyl)- ; 4-Tert-Butylcyclohexanecarboxylic Acid (cis- and trans- mixture) ; Cis-4-tert-Butylcyclohexanecarboxylic Acid .