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Home > Nitro Compounds > 881211-19-4
881211-19-4 | 5-(2-ethylphenoxy)-2-nitrobenzoic acid
CAS No: 881211-19-4 Catalog No: AG00H41F MDL No:
Product Description
Catalog Number:
AG00H41F
Chemical Name:
5-(2-ethylphenoxy)-2-nitrobenzoic acid
CAS Number:
881211-19-4
IUPAC Name:
5-(2-ethylphenoxy)-2-nitrobenzoic acid
InChI:
InChI=1S/C15H13NO5/c1-2-10-5-3-4-6-14(10)21-11-7-8-13(16(19)20)12(9-11)15(17)18/h3-9H,2H2,1H3,(H,17,18)
InChI Key:
LPSXKXKJESIUDS-UHFFFAOYSA-N
Properties
Complexity:
381
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.079g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
287.271g/mol
Monoisotopic Mass:
287.079g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
92.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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