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113258-92-7 | Benzoyl chloride, 2-iodo-4,5-dimethoxy-
CAS No: 113258-92-7 Catalog No: AG00823V MDL No:
Product Description
Catalog Number:
AG00823V
Chemical Name:
Benzoyl chloride, 2-iodo-4,5-dimethoxy-
CAS Number:
113258-92-7
Molecular Formula:
C9H8ClIO3
Molecular Weight:
326.5155
IUPAC Name:
2-iodo-4,5-dimethoxybenzoyl chloride
InChI:
InChI=1S/C9H8ClIO3/c1-13-7-3-5(9(10)12)6(11)4-8(7)14-2/h3-4H,1-2H3
InChI Key:
MMKOKTKTGNXIKS-UHFFFAOYSA-N
SMILES:
COc1cc(C(=O)Cl)c(cc1OC)I
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.921g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
326.514g/mol
Monoisotopic Mass:
325.921g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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