200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 899374-59-5
899374-59-5 | 1,4-Diacetyl-2,3-dimethyl-6-nitro-1,2,3,4-tetrahydroquinoxaline
CAS No: 899374-59-5 Catalog No: AG01E9N1 MDL No:
Product Description
Catalog Number:
AG01E9N1
Chemical Name:
1,4-Diacetyl-2,3-dimethyl-6-nitro-1,2,3,4-tetrahydroquinoxaline
CAS Number:
899374-59-5
Molecular Formula:
C14H17N3O4
Molecular Weight:
291.3025
IUPAC Name:
1-(4-acetyl-2,3-dimethyl-6-nitro-2,3-dihydroquinoxalin-1-yl)ethanone
InChI:
InChI=1S/C14H17N3O4/c1-8-9(2)16(11(4)19)14-7-12(17(20)21)5-6-13(14)15(8)10(3)18/h5-9H,1-4H3
InChI Key:
PMTHDUKCVRFGKD-UHFFFAOYSA-N
SMILES:
CC(=O)N1C(C)C(C)N(c2c1cc(cc2)[N+](=O)[O-])C(=O)C
Properties
Complexity:
462
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.122g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
291.307g/mol
Monoisotopic Mass:
291.122g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
86.4A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.