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2,3-Dichloro-5,6-dimethyl-benzoyl chloride,Benzoyl chloride, 2,3-dichl

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摘 要:2,3-Dichloro-5,6-dimethyl-benzoyl chloride,Benzoyl chloride, 2,3-dichloro-5,6-dimethyl-,1433-20-1, 2,3-dichloro-5,6-dimethylbenzoyl chloride,Canonical SMILES: CC1=CC(=C(C(=C1C)C(=O)Cl)Cl)Cl,InChI: InChI=1/C9H7Cl3O/c1-4-3-6(10)8(11)7(5(4)2)9(12)13/h3H
[Synonyms]
2,3-Dichloro-5,6-dimethyl-benzoyl chloride
Benzoyl chloride, 2,3-dichloro-5,6-dimethyl-
1433-20-1

[Structure]
2,3-Dichloro-5,6-dimethyl-benzoyl chloride,Benzoyl chloride, 2,3-dichl

[ Properties Computed from Structure]
Molecular Weight237.51028 [g/mol]
Molecular FormulaC9H7Cl3O
XLogP4.4
H-Bond Donor0
H-Bond Acceptor1
Rotatable Bond Count1
Exact Mass235.956248
MonoIsotopic Mass235.956248
Topological Polar Surface Area17.1
Heavy Atom Count13
Formal Charge0
Complexity207
Isotope Atom Count0
Defined Atom StereoCenter Count0
Undefined Atom StereoCenter Count0
Defined Bond StereoCenter Count0
Undefined Bond StereoCenter Count0
Covalently-Bonded Unit Count1

[ Descriptors Computed from Structure]
IUPAC Name: 2,3-dichloro-5,6-dimethylbenzoyl chloride
Canonical SMILES: CC1=CC(=C(C(=C1C)C(=O)Cl)Cl)Cl
InChI: InChI=1/C9H7Cl3O/c1-4-3-6(10)8(11)7(5(4)2)9(12)13/h3H,1-2H3

 
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