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49628-79-7 | Carbamic acid, 1H-benzimidazol-5-yl-, methyl ester (9CI)
CAS No: 49628-79-7 Catalog No: AG00DPFF MDL No:
Product Description
Catalog Number:
AG00DPFF
Chemical Name:
Carbamic acid, 1H-benzimidazol-5-yl-, methyl ester (9CI)
CAS Number:
49628-79-7
IUPAC Name:
methyl N-(3H-benzimidazol-5-yl)carbamate
InChI:
InChI=1S/C9H9N3O2/c1-14-9(13)12-6-2-3-7-8(4-6)11-5-10-7/h2-5H,1H3,(H,10,11)(H,12,13)
InChI Key:
ZWMMZWJKCRCKPF-UHFFFAOYSA-N
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.069g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
191.19g/mol
Monoisotopic Mass:
191.069g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
67A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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