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Home > Nitro Compounds > 1261908-88-6
1261908-88-6 | 3-(3-Methoxycarbonylphenyl)-5-nitrobenzoic acid
CAS No: 1261908-88-6 Catalog No: AG00HKOO MDL No:MFCD18321217
Product Description
Catalog Number:
AG00HKOO
Chemical Name:
3-(3-Methoxycarbonylphenyl)-5-nitrobenzoic acid
CAS Number:
1261908-88-6
MDL Number:
MFCD18321217
IUPAC Name:
3-(3-methoxycarbonylphenyl)-5-nitrobenzoic acid
InChI:
InChI=1S/C15H11NO6/c1-22-15(19)10-4-2-3-9(5-10)11-6-12(14(17)18)8-13(7-11)16(20)21/h2-8H,1H3,(H,17,18)
InChI Key:
PWINGVGBNUZPNV-UHFFFAOYSA-N
Properties
Complexity:
446
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.059g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
301.254g/mol
Monoisotopic Mass:
301.059g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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