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1-Methylbenzimidazole

CAT: 0931-TN9318-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-TN9318-01Size:50 mg
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CAS Number
1632-83-3
Target
Others
Related Pathways
Others
Purity
0.9991
Bioactivity
1-Methylbenzimidazole is a benzimidazole derivative widely used in biochemical experiments and drug synthesis research.
Smiles
N1=CN(C=2C=CC=CC12)C
Molecular Formula
C8H8N2
Molecular Weight
132.16
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

1H-Benzimidazole, 1-methyl-
CAS Number1632-83-3
PubChem CID95890
IUPAC Name1-methylbenzimidazole
Molecular FormulaC8H8N2
Molecular Weight132.16
XLogP1.4
Topological Polar Surface Area17.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count10
Formal Charge0
Complexity124
SMILES
CN1C=NC2=CC=CC=C21
InChI
InChI=1S/C8H8N2/c1-10-6-9-7-4-2-3-5-8(7)10/h2-6H,1H3
InChIKey
FGYADSCZTQOAFK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1H-Benzimidazole, 1-methyl-
CAS: 1632-83-3
CID: 95890
Formula: C8H8N2
MW: 132.16
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight132.16
XLogP31.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass132.068748264
Monoisotopic Mass132.068748264
Topological Polar Surface Area17.8 Ų
Heavy Atom Count10
Formal Charge0
Complexity124
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes