200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 89068-55-3
89068-55-3 | 1H-Pyrrole-2,5-dione, 3,4-dimethyl-1-(2-methylphenyl)-
CAS No: 89068-55-3 Catalog No: AG0040RX MDL No:
Product Description
Catalog Number:
AG0040RX
Chemical Name:
1H-Pyrrole-2,5-dione, 3,4-dimethyl-1-(2-methylphenyl)-
CAS Number:
89068-55-3
Molecular Formula:
C13H13NO2
Molecular Weight:
215.2478
IUPAC Name:
3,4-dimethyl-1-(2-methylphenyl)pyrrole-2,5-dione
InChI:
InChI=1S/C13H13NO2/c1-8-6-4-5-7-11(8)14-12(15)9(2)10(3)13(14)16/h4-7H,1-3H3
InChI Key:
GKCPRCYWAFEKRK-UHFFFAOYSA-N
SMILES:
O=C1C(=C(C(=O)N1c1ccccc1C)C)C
Properties
Complexity:
346
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.095g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
215.252g/mol
Monoisotopic Mass:
215.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.