Home Other Building Blocks 2,4-DIMETHYLBENZOYL CHLORIDE

2,4-DIMETHYLBENZOYL CHLORIDE

CAS No.:
21900-42-5
Catalog Number:
AG003FUE
Molecular Formula:
C9H9ClO
Molecular Weight:
168.6202
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Product Description
Catalog Number:
AG003FUE
Chemical Name:
2,4-DIMETHYLBENZOYL CHLORIDE
CAS Number:
21900-42-5
Molecular Formula:
C9H9ClO
Molecular Weight:
168.6202
MDL Number:
MFCD00798005
IUPAC Name:
2,4-dimethylbenzoyl chloride
InChI:
InChI=1S/C9H9ClO/c1-6-3-4-8(9(10)11)7(2)5-6/h3-5H,1-2H3
InChI Key:
JUOGRBULLOEKKQ-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1)C)C(=O)Cl
Properties
Complexity:
156  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.034g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.62g/mol
Monoisotopic Mass:
168.034g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties