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113576-12-8 | Benzoyl chloride, 4-[2-(4-formylphenyl)ethenyl]-
CAS No: 113576-12-8 Catalog No: AG00091A MDL No:
Product Description
Catalog Number:
AG00091A
Chemical Name:
Benzoyl chloride, 4-[2-(4-formylphenyl)ethenyl]-
CAS Number:
113576-12-8
Molecular Formula:
C16H11ClO2
Molecular Weight:
270.7103
IUPAC Name:
4-[2-(4-formylphenyl)ethenyl]benzoyl chloride
InChI:
InChI=1S/C16H11ClO2/c17-16(19)15-9-7-13(8-10-15)2-1-12-3-5-14(11-18)6-4-12/h1-11H
InChI Key:
GFRHPEFNMNJKDQ-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)C=Cc1ccc(cc1)C(=O)Cl
Properties
Complexity:
335
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.045g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
270.712g/mol
Monoisotopic Mass:
270.045g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.2
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