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Home > Nitro Compounds > 10565-13-6
10565-13-6 | Propanedioic acid, (4-nitrophenyl)-, diethyl ester
CAS No: 10565-13-6 Catalog No: AG00HAOE MDL No:MFCD06205063
Product Description
Catalog Number:
AG00HAOE
Chemical Name:
Propanedioic acid, (4-nitrophenyl)-, diethyl ester
CAS Number:
10565-13-6
MDL Number:
MFCD06205063
IUPAC Name:
diethyl 2-(4-nitrophenyl)propanedioate
InChI:
InChI=1S/C13H15NO6/c1-3-19-12(15)11(13(16)20-4-2)9-5-7-10(8-6-9)14(17)18/h5-8,11H,3-4H2,1-2H3
InChI Key:
VTWDYQVTRGDDEE-UHFFFAOYSA-N
Properties
Complexity:
338
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.09g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
281.264g/mol
Monoisotopic Mass:
281.09g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
98.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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