200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 645389-70-4
645389-70-4 | 1,10-Anthracenedione, 9-hydroxy-3-nitro-
CAS No: 645389-70-4 Catalog No: AG00H61K MDL No:
Product Description
Catalog Number:
AG00H61K
Chemical Name:
1,10-Anthracenedione, 9-hydroxy-3-nitro-
CAS Number:
645389-70-4
Molecular Formula:
C14H7NO5
Molecular Weight:
269.2091
IUPAC Name:
1-hydroxy-3-nitroanthracene-9,10-dione
InChI:
InChI=1S/C14H7NO5/c16-11-6-7(15(19)20)5-10-12(11)14(18)9-4-2-1-3-8(9)13(10)17/h1-6,16H
InChI Key:
KGZXPGUXBNWRFB-UHFFFAOYSA-N
SMILES:
O=C1C=C(C=C2C1=C(O)c1c(C2=O)cccc1)[N+](=O)[O-]
NSC Number:
400860
Properties
Complexity:
457
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.032g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
269.212g/mol
Monoisotopic Mass:
269.032g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
100A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.