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Home > Imidazoles > 64266-18-8
64266-18-8 | 1H-Benzimidazole-1-propanenitrile,2-methyl-(9CI)
CAS No: 64266-18-8 Catalog No: AG00EWJA MDL No:MFCD00457522
Product Description
Catalog Number:
AG00EWJA
Chemical Name:
1H-Benzimidazole-1-propanenitrile,2-methyl-(9CI)
CAS Number:
64266-18-8
Molecular Formula:
C11H11N3
Molecular Weight:
185.2251
MDL Number:
MFCD00457522
IUPAC Name:
3-(2-methylbenzimidazol-1-yl)propanenitrile
InChI:
InChI=1S/C11H11N3/c1-9-13-10-5-2-3-6-11(10)14(9)8-4-7-12/h2-3,5-6H,4,8H2,1H3
InChI Key:
OKPRJLQPVVMRMX-UHFFFAOYSA-N
SMILES:
N#CCCn1c(C)nc2c1cccc2
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.095g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
185.23g/mol
Monoisotopic Mass:
185.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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