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Home > Nitro Compounds > 78361-13-4
78361-13-4 | 5-(2-METHOXYETHOXY)-2-NITROBENZOIC ACID
CAS No: 78361-13-4 Catalog No: AG00ICXW MDL No:
Product Description
Catalog Number:
AG00ICXW
Chemical Name:
5-(2-METHOXYETHOXY)-2-NITROBENZOIC ACID
CAS Number:
78361-13-4
IUPAC Name:
5-(2-methoxyethoxy)-2-nitrobenzoic acid
InChI:
InChI=1S/C10H11NO6/c1-16-4-5-17-7-2-3-9(11(14)15)8(6-7)10(12)13/h2-3,6H,4-5H2,1H3,(H,12,13)
InChI Key:
KIIRJRFGMLKNOI-UHFFFAOYSA-N
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.059g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
241.199g/mol
Monoisotopic Mass:
241.059g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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