Home Halogens Benzenepropanoyl chloride, 4-chloro-

Benzenepropanoyl chloride, 4-chloro-

CAS No.:
52085-96-8
Catalog Number:
AG00DNGM
Molecular Formula:
C9H8Cl2O
Molecular Weight:
203.0652
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Product Description
Catalog Number:
AG00DNGM
Chemical Name:
Benzenepropanoyl chloride, 4-chloro-
CAS Number:
52085-96-8
Molecular Formula:
C9H8Cl2O
Molecular Weight:
203.0652
MDL Number:
MFCD08460401
IUPAC Name:
3-(4-chlorophenyl)propanoyl chloride
InChI:
InChI=1S/C9H8Cl2O/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-2,4-5H,3,6H2
InChI Key:
VGNRGOGIWXMVLI-UHFFFAOYSA-N
SMILES:
ClC(=O)CCc1ccc(cc1)Cl
Properties
Complexity:
151  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.995g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.062g/mol
Monoisotopic Mass:
201.995g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties