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Ethyl 2-cyano-3-(4-fluorophenyl)-2-propenoate

Ethyl 2-cyano-3-(4-fluorophenyl)-2-propenoate structure

CAS No:
18861-57-9
Formula:
C12H10FNO2
Chemical Name:
Ethyl 2-cyano-3-(4-fluorophenyl)-2-propenoate
Synonyms:
2-Propenoic acid,2-cyano-3-(4-fluorophenyl)-,ethyl ester;Cinnamic acid,α-cyano-p-fluoro-,ethyl ester;Ethyl 2-cyano-3-(4-fluorophenyl)-2-propenoate;Ethyl α-cyano-p-fluorocinnamate;2-Cyano-3-(4-fluorophenyl)acrylic acid ethyl ester;NSC 637292;3-(4-Fluorophenyl)-2-cyano-2-propenoic acid ethyl ester;Ethyl 2-cyano-3-(4-fluorophenyl)acrylate;1821104-33-9

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Ethyl 2-cyano-3-(4-fluorophenyl)-2-propenoate Basic Attributes

Molecular Weight：

219.2117032

Exact Mass：

219.21

EC Number：

242-633-7

NSC Number：

637292

DSSTox ID：

DTXSID80416726

Characteristics

PSA：

50.09000

XLogP3：

2.29578

Density：

1.212g/cm3

Melting Point：

90-92 °C

Boiling Point：

330.7ºC at 760mmHg

Flash Point：

153.8ºC

Refractive Index：

1.549

Vapor Pressure：

0.000164mmHg at 25°C

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

safety instructions：

Marks：

Precautionary statement(s)：

P305 + P351 + P338

Hazard Statements：

H302-H319

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:219.21
XLogP3:2.5
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:219.06955672
Monoisotopic Mass:219.06955672
Topological Polar Surface Area:50.1
Heavy Atom Count:16
Complexity:321
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Ethyl 2-cyano-3-(4-fluorophenyl)-2-propenoate

Basic Attributes
Characteristics
Safety Information
Computed Properties
Learn More Other Chemicals

Ethyl 2-cyano-3-(4-fluorophenyl)-2-propenoate

SDS

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