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Home > Nitro Compounds > 83573-57-3
83573-57-3 | p-(propoxycarbonyl)phenyl 3-nitro-p-toluate
CAS No: 83573-57-3 Catalog No: AG00GK7I MDL No:
Product Description
Catalog Number:
AG00GK7I
Chemical Name:
p-(propoxycarbonyl)phenyl 3-nitro-p-toluate
CAS Number:
83573-57-3
IUPAC Name:
(4-propoxycarbonylphenyl) 4-methyl-3-nitrobenzoate
InChI:
InChI=1S/C18H17NO6/c1-3-10-24-17(20)13-6-8-15(9-7-13)25-18(21)14-5-4-12(2)16(11-14)19(22)23/h4-9,11H,3,10H2,1-2H3
InChI Key:
JOUQWHISQQFODR-UHFFFAOYSA-N
EC Number:
280-491-8
Properties
Complexity:
480
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
343.106g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
343.335g/mol
Monoisotopic Mass:
343.106g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
98.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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