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17753-02-5 | 1H-Benzimidazole-2-methanol, 6-chloro-α-phenyl-
CAS No: 17753-02-5 Catalog No: AG0025DH MDL No:MFCD11106901
Product Description
Catalog Number:
AG0025DH
Chemical Name:
1H-Benzimidazole-2-methanol, 6-chloro-α-phenyl-
CAS Number:
17753-02-5
Molecular Formula:
C14H11ClN2O
Molecular Weight:
258.7029
MDL Number:
MFCD11106901
IUPAC Name:
(6-chloro-1H-benzimidazol-2-yl)-phenylmethanol
InChI:
InChI=1S/C14H11ClN2O/c15-10-6-7-11-12(8-10)17-14(16-11)13(18)9-4-2-1-3-5-9/h1-8,13,18H,(H,16,17)
InChI Key:
XYDXPSQRRZJMKY-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)[nH]c(n2)C(c1ccccc1)O
NSC Number:
78709
Properties
Complexity:
283
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.056g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
258.705g/mol
Monoisotopic Mass:
258.056g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
48.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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