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10394-39-5 | 5-METHOXY-1-METHYLBENZIMIDAZOLE
CAS No: 10394-39-5 Catalog No: AG0094PU MDL No:MFCD00962665
Product Description
Catalog Number:
AG0094PU
Chemical Name:
5-METHOXY-1-METHYLBENZIMIDAZOLE
CAS Number:
10394-39-5
Molecular Formula:
C9H10N2O
Molecular Weight:
162.1885
MDL Number:
MFCD00962665
IUPAC Name:
5-methoxy-1-methylbenzimidazole
InChI:
InChI=1S/C9H10N2O/c1-11-6-10-8-5-7(12-2)3-4-9(8)11/h3-6H,1-2H3
InChI Key:
HQACNRVQEIYCKZ-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)ncn2C
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.079g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
162.192g/mol
Monoisotopic Mass:
162.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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