200,000+ products from a single source!
sales@angenechem.com
Home > Imidazoles > 1345412-19-2
1345412-19-2 | 4-(1H-IMIDAZOL-1-YLMETHYL)-2-METHYLBENZONITRILE
CAS No: 1345412-19-2 Catalog No: AG01DVW1 MDL No:MFCD28129292
Product Description
Catalog Number:
AG01DVW1
Chemical Name:
4-(1H-IMIDAZOL-1-YLMETHYL)-2-METHYLBENZONITRILE
CAS Number:
1345412-19-2
Molecular Formula:
C12H11N3
Molecular Weight:
197.2358
MDL Number:
MFCD28129292
IUPAC Name:
4-(imidazol-1-ylmethyl)-2-methylbenzonitrile
InChI:
InChI=1S/C12H11N3/c1-10-6-11(2-3-12(10)7-13)8-15-5-4-14-9-15/h2-6,9H,8H2,1H3
InChI Key:
RSUOWSGFGSNUNC-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1C)Cn1cncc1
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.095g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.241g/mol
Monoisotopic Mass:
197.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.