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Benzoic acid, 4-propyl-, 4-cyano-3-fluorophenyl ester

Benzoic acid, 4-propyl-, 4-cyano-3-fluorophenyl ester structure

CAS No:
86776-51-4
Formula:
C17H14FNO2
Chemical Name:
Benzoic acid, 4-propyl-, 4-cyano-3-fluorophenyl ester
Synonyms:
Benzoic acid,4-propyl-,4-cyano-3-fluorophenyl ester;3-Fluoro-4-cyanophenyl 4-propylbenzoate;ME 3N.F;3-BEB(F)-C;PZG-3-N;(4-Cyano-3-fluorophenyl) 4-propylbenzoate

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Benzoic acid, 4-propyl-, 4-cyano-3-fluorophenyl ester Basic Attributes

Molecular Weight：

283.29700

Exact Mass：

283.30

EC Number：

617-917-2

DSSTox ID：

DTXSID70343496

HScode：

2926909090

Characteristics

PSA：

50.09000

XLogP3：

3.86908

Boiling Point：

426.585ºC

Flash Point：

211.791ºC

Safety Information

GHS Classification：

|Warning|H302+H312+H332 (50%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]|P261, P264, P270, P271, P273, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:283.30
XLogP3:4.5
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:283.10085685
Monoisotopic Mass:283.10085685
Topological Polar Surface Area:50.1
Heavy Atom Count:21
Complexity:395
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Benzoic acid, 4-propyl-, 4-cyano-3-fluorophenyl ester

Basic Attributes
Characteristics
Safety Information
Computed Properties
Learn More Other Chemicals

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