200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 17721-91-4
17721-91-4 | 1H-Inden-1-one, 3-hydroxy-2-(4-nitrophenyl)-
CAS No: 17721-91-4 Catalog No: AG00256M MDL No:MFCD00239207
Product Description
Catalog Number:
AG00256M
Chemical Name:
1H-Inden-1-one, 3-hydroxy-2-(4-nitrophenyl)-
CAS Number:
17721-91-4
Molecular Formula:
C15H9NO4
Molecular Weight:
267.2363
MDL Number:
MFCD00239207
IUPAC Name:
3-hydroxy-2-(4-nitrophenyl)inden-1-one
InChI:
InChI=1S/C15H9NO4/c17-14-11-3-1-2-4-12(11)15(18)13(14)9-5-7-10(8-6-9)16(19)20/h1-8,17H
InChI Key:
JQBCOAGLBYZCAU-UHFFFAOYSA-N
SMILES:
O=C1c2ccccc2C(=C1c1ccc(cc1)[N+](=O)[O-])O
Properties
Complexity:
457
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.053g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
267.24g/mol
Monoisotopic Mass:
267.053g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.