Cyclohexanecarboxylicacid, 1-fluoro- supplier

Name
1-FLUOROCYCLOHEXANECARBOXYLIC ACID
EINECS
CAS No. 117169-31-0
Article Data2
CAS DataBase
Density 1.15 g/cm³
Solubility
Melting Point
Formula C₇H₁₁FO₂
Boiling Point 227.566 °C at 760 mmHg
Molecular Weight 146.1594432
Flash Point 91.429 °C
Transport Information
Appearance
Safety
Risk Codes Xi:;
Molecular Structure
Hazard Symbols Xi
Synonyms 1-Fluorocyclohexane-1-carboxylic acid;
PSA 37.30000
LogP 1.74340

Cyclohexanecarboxylicacid, 1-fluoro- Specification

The Cyclohexanecarboxylicacid, 1-fluoro-, with the CAS registry number of 117169-31-0, is also known as 1-Fluorocylcohexanecarboxylic acid. It belongs to the product categories of Carboxylicacid; Halide; Carboxylic Acids; Carboxylic Acids; Ring Systems. This chemical's molecular formula is C₇H₁₁FO₂ and molecular weight is 146.1594432. What's more, its IUPAC name is 1-Fluorocyclohexane-1-carboxylic acid. In addition, this chemical may cause inflammation to the skin or other mucous membranes.

Physical properties about Cyclohexanecarboxylicacid, 1-fluoro- are: (1)ACD/LogP: 1.48; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 2; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 37.3 Å²; (11)Index of Refraction: 1.454; (12)Molar Refractivity: 34.188 cm³; (13)Molar Volume: 126.138 cm³; (14)Surface Tension: 35.72 dyne/cm; (15)Density: 1.159 g/cm³; (16)Flash Point: 91.429 °C; (17)Enthalpy of Vaporization: 51.13 kJ/mol; (18)Boiling Point: 227.566 °C at 760 mmHg; (19)Vapour Pressure: 0.028 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: C1CCC(CC1)(C(=O)O)F
(2) InChI: InChI=1/C7H11FO2/c8-7(6(9)10)4-2-1-3-5-7/h1-5H2,(H,9,10)
(3) InChIKey: KPHYQWGKSTZREA-UHFFFAOYAM

Product Name

1-FLUOROCYCLOHEXANECARBOXYLIC ACID

Cyclohexanecarboxylicacid, 1-fluoro- Specification

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