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93661-57-5 | 1H-Benzimidazole, 1,3-diethyl-2,3-dihydro-2-methylene-
CAS No: 93661-57-5 Catalog No: AG0061MC MDL No:
Product Description
Catalog Number:
AG0061MC
Chemical Name:
1H-Benzimidazole, 1,3-diethyl-2,3-dihydro-2-methylene-
CAS Number:
93661-57-5
Molecular Formula:
C12H16N2
Molecular Weight:
188.2688
IUPAC Name:
1,3-diethyl-2-methylidenebenzimidazole
InChI:
InChI=1S/C12H16N2/c1-4-13-10(3)14(5-2)12-9-7-6-8-11(12)13/h6-9H,3-5H2,1-2H3
InChI Key:
SHYTXTWQVLSMHK-UHFFFAOYSA-N
SMILES:
CCn1c(=C)n(c2c1cccc2)CC
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.131g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.274g/mol
Monoisotopic Mass:
188.131g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
6.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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