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Home > Nitro Compounds > 90923-45-8
90923-45-8 | 4-(2-methoxyethoxy)-3-nitrobenzoic acid
CAS No: 90923-45-8 Catalog No: AG019URU MDL No:MFCD09808418
Product Description
Catalog Number:
AG019URU
Chemical Name:
4-(2-methoxyethoxy)-3-nitrobenzoic acid
CAS Number:
90923-45-8
Molecular Formula:
C10H11NO6
Molecular Weight:
241.1974
MDL Number:
MFCD09808418
IUPAC Name:
4-(2-methoxyethoxy)-3-nitrobenzoic acid
InChI:
InChI=1S/C10H11NO6/c1-16-4-5-17-9-3-2-7(10(12)13)6-8(9)11(14)15/h2-3,6H,4-5H2,1H3,(H,12,13)
InChI Key:
DDPDFCFYFNARNH-UHFFFAOYSA-N
SMILES:
COCCOc1ccc(cc1[N+](=O)[O-])C(=O)O
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:
1.1
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