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Home > Imidazoles > 655235-91-9
655235-91-9 | 2-(5-FORMYL-IMIDAZOL-1-YLMETHYL)-BENZONITRILE
CAS No: 655235-91-9 Catalog No: AG00EBCL MDL No:
Product Description
Catalog Number:
AG00EBCL
Chemical Name:
2-(5-FORMYL-IMIDAZOL-1-YLMETHYL)-BENZONITRILE
CAS Number:
655235-91-9
IUPAC Name:
2-[(5-formylimidazol-1-yl)methyl]benzonitrile
InChI:
InChI=1S/C12H9N3O/c13-5-10-3-1-2-4-11(10)7-15-9-14-6-12(15)8-16/h1-4,6,8-9H,7H2
InChI Key:
ONFSAVPJNBBHDP-UHFFFAOYSA-N
Properties
Complexity:
296
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.075g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
211.224g/mol
Monoisotopic Mass:
211.075g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
58.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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