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Home > Nitro Compounds > 870280-80-1
870280-80-1 | 2-(4-morpholinylmethyl)-6-nitrobenzoic acid
CAS No: 870280-80-1 Catalog No: AG00H3QD MDL No:
Product Description
Catalog Number:
AG00H3QD
Chemical Name:
2-(4-morpholinylmethyl)-6-nitrobenzoic acid
CAS Number:
870280-80-1
IUPAC Name:
2-(morpholin-4-ylmethyl)-6-nitrobenzoic acid
InChI:
InChI=1S/C12H14N2O5/c15-12(16)11-9(2-1-3-10(11)14(17)18)8-13-4-6-19-7-5-13/h1-3H,4-8H2,(H,15,16)
InChI Key:
HOGPKNMMOUTFJO-UHFFFAOYSA-N
Properties
Complexity:
338
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.09g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
266.253g/mol
Monoisotopic Mass:
266.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
95.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.5
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