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Trichloromethylstyrene

HCID 5373085
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Basic information

CAS
60504-00-9
Standard SMILES
ClC(Cl)(Cl)/C=C/c1ccccc1
InChIKey
NUDSHVLUIKPZLF-VOTSOKGWSA-N
Molecular formula
C9H7Cl3
Average molar mass
221.5 g/mol
Monoisotopic mass
219.961333

Overview

See also: Benzene, (3,3,3-trichloro-1-propen-1-yl)- (annotation moved to).

Names & identifiers

Preferred name
Trichloromethylstyrene
IUPAC
[(E)-3,3,3-trichloroprop-1-enyl]benzene

Names & synonyms

EINECS 262-805-5Trichloromethylstyrene61465-75-6(3,3,3-trichloroprop-1-en-1-yl)benzene60504-00-9DTXSID6069406NUDSHVLUIKPZLF-VOTSOKGWSA-N1,1,1-trichloro-3-phenylpropene-2[(1E)-3,3,3-Trichloro-1-propenyl]benzene #Benzene, (3,3,3-trichloro-1-propenyl)-, (E)-

Database identifiers

CAS
60504-00-9、61465-75-6
PubChem CID
5373085
EC Number
262-269-2、262-805-5
Nikkaji
J268.213C

Properties

Computed structural properties

XLogP
4.5
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
1
Heavy atoms
12
Formal charge
0
Complexity
152

Related reactions

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Compound notes

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