200,000+ products from a single source!
sales@angenechem.com
Home > Imidazoles > 89250-45-3
89250-45-3 | Methanimidamide, N-cyano-N'-[4-(1H-imidazol-4-yl)-2-methylphenyl]-
CAS No: 89250-45-3 Catalog No: AG0041UU MDL No:
Product Description
Catalog Number:
AG0041UU
Chemical Name:
Methanimidamide, N-cyano-N'-[4-(1H-imidazol-4-yl)-2-methylphenyl]-
CAS Number:
89250-45-3
Molecular Formula:
C12H11N5
Molecular Weight:
225.2492
IUPAC Name:
N-cyano-N'-[4-(1H-imidazol-5-yl)-2-methylphenyl]methanimidamide
InChI:
InChI=1S/C12H11N5/c1-9-4-10(12-5-14-7-17-12)2-3-11(9)16-8-15-6-13/h2-5,7-8H,1H3,(H,14,17)(H,15,16)
InChI Key:
KVBFGJHQGLBKFA-UHFFFAOYSA-N
SMILES:
N#CNC=Nc1ccc(cc1C)c1c[nH]cn1
Properties
Complexity:
318
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.101g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
225.255g/mol
Monoisotopic Mass:
225.101g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
76.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.