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Home > Nitro Compounds > 1019461-42-7
1019461-42-7 | 4-(2-Methyl-1-piperidinyl)-3-nitrobenzoic acid
CAS No: 1019461-42-7 Catalog No: AG01DO6L MDL No:MFCD11039342
Product Description
Catalog Number:
AG01DO6L
Chemical Name:
4-(2-Methyl-1-piperidinyl)-3-nitrobenzoic acid
CAS Number:
1019461-42-7
MDL Number:
MFCD11039342
IUPAC Name:
4-(2-methylpiperidin-1-yl)-3-nitrobenzoic acid
InChI:
InChI=1S/C13H16N2O4/c1-9-4-2-3-7-14(9)11-6-5-10(13(16)17)8-12(11)15(18)19/h5-6,8-9H,2-4,7H2,1H3,(H,16,17)
InChI Key:
UHWPLXRYHKRNJP-UHFFFAOYSA-N
Properties
Complexity:
355
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.111g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
264.281g/mol
Monoisotopic Mass:
264.111g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
86.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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