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Home > Nitro Compounds > 81425-61-8
81425-61-8 | DI-FURAN-2-YLPHOSPHINIC ACID 4-NITROPHENYL ESTER
CAS No: 81425-61-8 Catalog No: AG005KKE MDL No:
Product Description
Catalog Number:
AG005KKE
Chemical Name:
DI-FURAN-2-YLPHOSPHINIC ACID 4-NITROPHENYL ESTER
CAS Number:
81425-61-8
Molecular Formula:
C14H10NO6P
Molecular Weight:
319.2061
IUPAC Name:
2-[furan-2-yl-(4-nitrophenoxy)phosphoryl]furan
InChI:
InChI=1S/C14H10NO6P/c16-15(17)11-5-7-12(8-6-11)21-22(18,13-3-1-9-19-13)14-4-2-10-20-14/h1-10H
InChI Key:
NCZNTVGTGNBPLP-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)OP(=O)(c1ccco1)c1ccco1
Properties
Complexity:
425
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.025g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
319.209g/mol
Monoisotopic Mass:
319.025g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
98.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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