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1018895-06-1 | 1H-Benzimidazol-2-amine, 7-methoxy-
CAS No: 1018895-06-1 Catalog No: AG0005U8 MDL No:MFCD16659610
Product Description
Catalog Number:
AG0005U8
Chemical Name:
1H-Benzimidazol-2-amine, 7-methoxy-
CAS Number:
1018895-06-1
Molecular Formula:
C8H9N3O
Molecular Weight:
163.1766
MDL Number:
MFCD16659610
IUPAC Name:
4-methoxy-1H-benzimidazol-2-amine
InChI:
InChI=1S/C8H9N3O/c1-12-6-4-2-3-5-7(6)11-8(9)10-5/h2-4H,1H3,(H3,9,10,11)
InChI Key:
JXZONHOHNHEXOQ-UHFFFAOYSA-N
SMILES:
COc1cccc2c1[nH]c(n2)N
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.075g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
163.18g/mol
Monoisotopic Mass:
163.075g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
63.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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