Home Halogens Benzoyl chloride, 3-chloro-4-methyl-

Benzoyl chloride, 3-chloro-4-methyl-

CAS No.:
21900-30-1
Catalog Number:
AG007OU1
Molecular Formula:
C8H6Cl2O
Molecular Weight:
189.0386
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Product Description
Catalog Number:
AG007OU1
Chemical Name:
Benzoyl chloride, 3-chloro-4-methyl-
CAS Number:
21900-30-1
Molecular Formula:
C8H6Cl2O
Molecular Weight:
189.0386
MDL Number:
MFCD07787492
IUPAC Name:
3-chloro-4-methylbenzoyl chloride
InChI:
InChI=1S/C8H6Cl2O/c1-5-2-3-6(8(10)11)4-7(5)9/h2-4H,1H3
InChI Key:
GANDSBWEBNXLMG-UHFFFAOYSA-N
SMILES:
ClC(=O)c1ccc(c(c1)Cl)C
Properties
Complexity:
158  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.98g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.035g/mol
Monoisotopic Mass:
187.98g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1  
Properties