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65657-54-7 | 1H-Benzimidazole-1-carbonyl chloride, 2,3-dihydro-3-methyl-2-oxo-
CAS No: 65657-54-7 Catalog No: AG006PWQ MDL No:
Product Description
Catalog Number:
AG006PWQ
Chemical Name:
1H-Benzimidazole-1-carbonyl chloride, 2,3-dihydro-3-methyl-2-oxo-
CAS Number:
65657-54-7
Molecular Formula:
C9H7ClN2O2
Molecular Weight:
210.6171
IUPAC Name:
3-methyl-2-oxobenzimidazole-1-carbonyl chloride
InChI:
InChI=1S/C9H7ClN2O2/c1-11-6-4-2-3-5-7(6)12(8(10)13)9(11)14/h2-5H,1H3
InChI Key:
GHVRHFCPWGXLDQ-UHFFFAOYSA-N
SMILES:
Cn1c(=O)n(c2c1cccc2)C(=O)Cl
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.02g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.617g/mol
Monoisotopic Mass:
210.02g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
40.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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