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Home > Imidazoles > 739302-05-7
739302-05-7 | 1H-Benzimidazolium, 2,3-dimethyl-
CAS No: 739302-05-7 Catalog No: AG005VRX MDL No:
Product Description
Catalog Number:
AG005VRX
Chemical Name:
1H-Benzimidazolium, 2,3-dimethyl-
CAS Number:
739302-05-7
Molecular Formula:
C9H13N2+
Molecular Weight:
149.2129
IUPAC Name:
2,3-dimethyl-1,2-dihydrobenzimidazol-1-ium
InChI:
InChI=1S/C9H12N2/c1-7-10-8-5-3-4-6-9(8)11(7)2/h3-7,10H,1-2H3/p+1
InChI Key:
VSJKGWNZJOGGMH-UHFFFAOYSA-O
SMILES:
CC1[NH2+]c2c(N1C)cccc2
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.108g/mol
Formal Charge:
1
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
149.217g/mol
Monoisotopic Mass:
149.108g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
19.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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