200,000+ products from a single source!
sales@angenechem.com
189083-16-7 | Acetic acid, 2-(6-nitro-4-oxo-2H-1-benzopyran-3(4H)-ylidene)-
CAS No: 189083-16-7 Catalog No: AG002HUX MDL No:
Product Description
Catalog Number:
AG002HUX
Chemical Name:
Acetic acid, 2-(6-nitro-4-oxo-2H-1-benzopyran-3(4H)-ylidene)-
CAS Number:
189083-16-7
Molecular Formula:
C11H7NO6
Molecular Weight:
249.1764
IUPAC Name:
2-(6-nitro-4-oxochromen-3-ylidene)acetic acid
InChI:
InChI=1S/C11H7NO6/c13-10(14)3-6-5-18-9-2-1-7(12(16)17)4-8(9)11(6)15/h1-4H,5H2,(H,13,14)
InChI Key:
KAZJYVFNRYIHNT-UHFFFAOYSA-N
SMILES:
OC(=O)C=C1COc2c(C1=O)cc(cc2)[N+](=O)[O-]
Properties
Complexity:
424
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.027g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
249.178g/mol
Monoisotopic Mass:
249.027g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
0.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.