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Cyclohexanecarboxylic acid, 4-fluoro-, trans- (9CI)

Cyclohexanecarboxylic acid, 4-fluoro-, trans- (9CI) structure

CAS No:
174771-54-1
Formula:
C7H11FO2
Chemical Name:
Cyclohexanecarboxylic acid, 4-fluoro-, trans- (9CI)
Synonyms:
Cyclohexanecarboxylic acid, 4-fluoro-, trans- (9CI);trans-4-Fluorocyclohexanecarboxylic Acid;4-Fluorocyclohexane-1-carboxylic acid;trans-4-Fluorocyclohexane-1-carboxylic Acid;trans-4-Fluorocyclohexanoic Acid;trans-4-Fluorocyclohexylcarboxylic Acid;CYCLOHEXANECARBOXYLIC ACID 4-FLUORO-,TRANS-

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Cyclohexanecarboxylic acid, 4-fluoro-, trans- (9CI) Basic Attributes

Molecular Weight：

146.1594432

Exact Mass：

146.074310

HScode：

2916209090

Characteristics

PSA：

37.30000

XLogP3：

1.19

Density：

1.2±0.1 g/cm3

Boiling Point：

248.8±33.0 °C at 760 mmHg

Flash Point：

104.3±25.4 °C

Refractive Index：

1.450

Safety Information

Hazard category：

IRRITANT

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 90 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

4-fluorocC6COOH

Cyclohexanecarboxylic acid, 4-fluoro-, trans- (9CI) Use and Manufacturing

A mono-substituted cyclohexane carboxylic acid used in the preparation of an analog of the 5-HT1A receptor antagonist.

Computed Properties

Molecular Weight:146.16
XLogP3:1.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:146.07430775
Monoisotopic Mass:146.07430775
Topological Polar Surface Area:37.3
Heavy Atom Count:10
Complexity:128
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Cyclohexanecarboxylic acid, 4-fluoro-, trans- (9CI)

Basic Attributes
Characteristics
Safety Information
Drug Information
Use and Manufacturing
Computed Properties
Learn More Other Chemicals

Cyclohexanecarboxylic acid, 4-fluoro-, trans- (9CI)

SDS

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