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Home > Nitro Compounds > 898758-89-9
898758-89-9 | ETHYL 4-(4-METHOXY-3-NITROPHENYL)-4-OXOBUTYRATE
CAS No: 898758-89-9 Catalog No: AG00GZ5B MDL No:
Product Description
Catalog Number:
AG00GZ5B
Chemical Name:
ETHYL 4-(4-METHOXY-3-NITROPHENYL)-4-OXOBUTYRATE
CAS Number:
898758-89-9
IUPAC Name:
ethyl 4-(4-methoxy-3-nitrophenyl)-4-oxobutanoate
InChI:
InChI=1S/C13H15NO6/c1-3-20-13(16)7-5-11(15)9-4-6-12(19-2)10(8-9)14(17)18/h4,6,8H,3,5,7H2,1-2H3
InChI Key:
ZWCYYJDMELCTCR-UHFFFAOYSA-N
Properties
Complexity:
364
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:
1.5
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