200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 82420-02-8
82420-02-8 | 3,3'-[(4-nitrophenyl)methanediyl]bis(2-hydroxy-6-methyl-4h-pyran-4-one)
CAS No: 82420-02-8 Catalog No: AG004WR3 MDL No:
Product Description
Catalog Number:
AG004WR3
Chemical Name:
3,3'-[(4-nitrophenyl)methanediyl]bis(2-hydroxy-6-methyl-4h-pyran-4-one)
CAS Number:
82420-02-8
Molecular Formula:
C19H15NO8
Molecular Weight:
385.3243
IUPAC Name:
4-hydroxy-3-[(4-hydroxy-6-methyl-2-oxopyran-3-yl)-(4-nitrophenyl)methyl]-6-methylpyran-2-one
InChI:
InChI=1S/C19H15NO8/c1-9-7-13(21)16(18(23)27-9)15(11-3-5-12(6-4-11)20(25)26)17-14(22)8-10(2)28-19(17)24/h3-8,15,21-22H,1-2H3
InChI Key:
HYWYHSJBMSGAOX-UHFFFAOYSA-N
SMILES:
Oc1oc(C)cc(=O)c1C(c1c(=O)cc(oc1O)C)c1ccc(cc1)[N+](=O)[O-]
NSC Number:
34909
Properties
Complexity:
796
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
385.08g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
385.328g/mol
Monoisotopic Mass:
385.08g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
139A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.