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88346-07-0 | 1H-Benzimidazolium, 1-methyl-3-(phenylmethyl)-, chloride
CAS No: 88346-07-0 Catalog No: AG0046FL MDL No:
Product Description
Catalog Number:
AG0046FL
Chemical Name:
1H-Benzimidazolium, 1-methyl-3-(phenylmethyl)-, chloride
CAS Number:
88346-07-0
Molecular Formula:
C15H17ClN2
Molecular Weight:
260.7619
IUPAC Name:
3-benzyl-1-methyl-1,2-dihydrobenzimidazol-1-ium;chloride
InChI:
InChI=1S/C15H16N2.ClH/c1-16-12-17(11-13-7-3-2-4-8-13)15-10-6-5-9-14(15)16;/h2-10H,11-12H2,1H3;1H
InChI Key:
LEBXMTNMUJWPSE-UHFFFAOYSA-N
SMILES:
C[NH+]1CN(c2c1cccc2)Cc1ccccc1.[Cl-]
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.108g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
260.765g/mol
Monoisotopic Mass:
260.108g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
7.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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