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2-(2-CHLOROACETYL)-3-(DIMETHYLAMINO)ACRYLONITRILE

2-(2-CHLOROACETYL)-3-(DIMETHYLAMINO)ACRYLONITRILE structure

CAS No:
339097-02-8
Formula:
C7H9ClN2O
Chemical Name:
2-(2-CHLOROACETYL)-3-(DIMETHYLAMINO)ACRYLONITRILE
Synonyms:
ZINC170207;(2E)-4-chloro-2-[(dimethylamino)methylidene]-3-oxobutanenitrile;SBB088721;AKOS005071121;8H-035;(2E)-3-(dimethylamino)-2-(2-chloroacetyl)prop-2-enenitrile

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2-(2-CHLOROACETYL)-3-(DIMETHYLAMINO)ACRYLONITRILE Basic Attributes

Molecular Weight：

172.61

Exact Mass：

172.040341

Characteristics

PSA：

44.1

Melting Point：

140-142°C

Safety Information

Hazard category：

IRRITANT

Computed Properties

Molecular Weight:172.61
XLogP3:0.9
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:172.0403406
Monoisotopic Mass:172.0403406
Topological Polar Surface Area:44.1
Heavy Atom Count:11
Complexity:224
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: 2 hexanone; na2o sodium oxide; 2-butanol; 2 methyl 2 butene; formula for ammonia sulfate; acetate formula

Guide of 2-(2-CHLOROACETYL)-3-(DIMETHYLAMINO)ACRYLONITRILE

Basic Attributes
Characteristics
Safety Information
Computed Properties

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