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trans-Crotononitrile

trans-Crotononitrile structure

CAS No:
627-26-9
Formula:
C4H5N
Chemical Name:
trans-Crotononitrile
Synonyms:
2-Butenenitrile,(2E)-;Crotononitrile,(E)-;2-Butenenitrile,(E)-;trans-1-Propenyl cyanide;trans-Crotononitrile;trans-2-Butenenitrile;trans-Crotonitrile;(E)-Crotononitrile;trans-β-Methylacrylonitrile;(E)-2-Butenenitrile;(2E)-But-2-enenitrile;(E)-But-2-enenitrile;(2E)-But-2-enenitrile
Categories:
Organic Chemistry > Nitrile Compound

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trans-Crotononitrile Basic Attributes

Molecular Weight：

67.091

Exact Mass：

67.09

EC Number：

225-335-1

UNII：

E74GS2HL23

UN Number：

2924

DSSTox ID：

DTXSID0063604

Characteristics

PSA：

23.8

XLogP3：

0.8

Density：

0.84046 g/cm³ @ Temp: 0 °C

Melting Point：

-51.5 °C

Boiling Point：

120 °C

Flash Point：

16°C(lit.)

Water Solubility：

0.37 M

Vapor Pressure：

31.95 mmHg

Safety Information

Hazard category：

Transport codes：

UN 1993 3/PG II

RTECS Number：

EM8020000

Precautionary statement(s)：

P210, P233, P240, P241, P242, P243, P264, P270, P280, P301+P312, P302+P352, P303+P361+P353, P305+P351+P338, P321, P330, P332+P313, P337+P313, P362, P370+P378, P403+P235, P501

Hazard Statements：

H225

Fire Hazards：

Flammable - 3rd degree, Reactive - 1st degree

GHS Classification：

|Danger|H225 (99.04%): Highly Flammable liquid and vapor [Danger Flammable liquids]|P210, P233, P240, P241, P242, P243, P261, P264, P270, P271, P280, P301+P312, P302+P352, P303+P361+P353, P304+P312, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P370+P378, P403+P233, P403+P235, P405, and P501|Aggregated GHS information provided by 104 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]|P210, P233, P240, P241, P242, P243, P264, P270, P280, P301+P312, P302+P352, P303+P361+P353, P305+P351+P338, P321, P330, P332+P313, P337+P313, P362, P370+P378, P403+P235, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Drug Information

MeSH Entry Terms：

2-butenenitrile

trans-Crotononitrile Use and Manufacturing

Manufacturing Info：

2-Butenenitrile: ACTIVE

Use Classification：

Fire Hazards -> Flammable - 3rd degree, Reactive - 1st degree

Computed Properties

Molecular Weight:67.09
XLogP3:0.8
Hydrogen Bond Acceptor Count:1
Exact Mass:67.042199164
Monoisotopic Mass:67.042199164
Topological Polar Surface Area:23.8
Heavy Atom Count:5
Complexity:72.9
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Recommended Suppliers of trans-Crotononitrile

Creasyn Finechem(Tianjin) Co., Ltd. Contact Supplier

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3 YRS

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Trader Supplier of N,N'-Dimethylethylenediamine

trans-Crotononitrile

CAS No.: 627-26-9

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