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Home > Bromides > 1565461-85-9
1565461-85-9 | 1H-Benzimidazole-2-methanol, 5-bromo-7-methyl-
CAS No: 1565461-85-9 Catalog No: AG001OS8 MDL No:MFCD26912934
Product Description
Catalog Number:
AG001OS8
Chemical Name:
1H-Benzimidazole-2-methanol, 5-bromo-7-methyl-
CAS Number:
1565461-85-9
Molecular Formula:
C9H9BrN2O
Molecular Weight:
241.0846
MDL Number:
MFCD26912934
IUPAC Name:
(6-bromo-4-methyl-1H-benzimidazol-2-yl)methanol
InChI:
InChI=1S/C9H9BrN2O/c1-5-2-6(10)3-7-9(5)12-8(4-13)11-7/h2-3,13H,4H2,1H3,(H,11,12)
InChI Key:
IGUTZNNRTGLWSB-UHFFFAOYSA-N
SMILES:
OCc1nc2c([nH]1)c(C)cc(c2)Br
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.99g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
241.088g/mol
Monoisotopic Mass:
239.99g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
48.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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