200,000+ products from a single source!
sales@angenechem.com
101-15-5 | 2,5-Cyclohexadien-1-one, 4-[(4-amino-3-methylphenyl)imino]-
CAS No: 101-15-5 Catalog No: AG0003EX MDL No:
Product Description
Catalog Number:
AG0003EX
Chemical Name:
2,5-Cyclohexadien-1-one, 4-[(4-amino-3-methylphenyl)imino]-
CAS Number:
101-15-5
Molecular Formula:
C13H12N2O
Molecular Weight:
212.2472
IUPAC Name:
4-(4-amino-3-methylphenyl)iminocyclohexa-2,5-dien-1-one
InChI:
InChI=1S/C13H12N2O/c1-9-8-11(4-7-13(9)14)15-10-2-5-12(16)6-3-10/h2-8H,14H2,1H3
InChI Key:
RWIMGHAFJNQGDH-UHFFFAOYSA-N
SMILES:
O=C1C=CC(=Nc2ccc(c(c2)C)N)C=C1
EC Number:
202-919-4
Properties
Complexity:
350
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.095g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
212.252g/mol
Monoisotopic Mass:
212.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
55.4A^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.