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Home > Nitro Compounds > 942474-64-8
942474-64-8 | 4-(2,6-DIMETHYLMORPHOLIN-4-YL)-3-NITROBENZOIC ACID
CAS No: 942474-64-8 Catalog No: AG00H0JB MDL No:MFCD08692433
Product Description
Catalog Number:
AG00H0JB
Chemical Name:
4-(2,6-DIMETHYLMORPHOLIN-4-YL)-3-NITROBENZOIC ACID
CAS Number:
942474-64-8
MDL Number:
MFCD08692433
IUPAC Name:
4-(2,6-dimethylmorpholin-4-yl)-3-nitrobenzoic acid
InChI:
InChI=1S/C13H16N2O5/c1-8-6-14(7-9(2)20-8)11-4-3-10(13(16)17)5-12(11)15(18)19/h3-5,8-9H,6-7H2,1-2H3,(H,16,17)
InChI Key:
MTYJFJLVTITZPT-UHFFFAOYSA-N
Properties
Complexity:
373
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.106g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
280.28g/mol
Monoisotopic Mass:
280.106g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
95.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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