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1565-41-9 | Benzoyl chloride, 4-ethenyl-
CAS No: 1565-41-9 Catalog No: AG001OS4 MDL No:
Product Description
Catalog Number:
AG001OS4
Chemical Name:
Benzoyl chloride, 4-ethenyl-
CAS Number:
1565-41-9
Molecular Formula:
C9H7ClO
Molecular Weight:
166.6043
IUPAC Name:
4-ethenylbenzoyl chloride
InChI:
InChI=1S/C9H7ClO/c1-2-7-3-5-8(6-4-7)9(10)11/h2-6H,1H2
InChI Key:
DGZXVEAMYQEFHB-UHFFFAOYSA-N
SMILES:
C=Cc1ccc(cc1)C(=O)Cl
Properties
Complexity:
157
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.019g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
166.604g/mol
Monoisotopic Mass:
166.019g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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