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Home > Nitro Compounds > 36894-27-6
36894-27-6 | N-(2-nitrophenyl)morpholine-4-carboxamide
CAS No: 36894-27-6 Catalog No: AG00JH7T MDL No:MFCD02974335
Product Description
Catalog Number:
AG00JH7T
Chemical Name:
N-(2-nitrophenyl)morpholine-4-carboxamide
CAS Number:
36894-27-6
Molecular Formula:
C11H13N3O4
Molecular Weight:
251.2386
MDL Number:
MFCD02974335
IUPAC Name:
N-(2-nitrophenyl)morpholine-4-carboxamide
InChI:
InChI=1S/C11H13N3O4/c15-11(13-5-7-18-8-6-13)12-9-3-1-2-4-10(9)14(16)17/h1-4H,5-8H2,(H,12,15)
InChI Key:
JBKALUPUEFUREP-UHFFFAOYSA-N
SMILES:
O=C(N1CCOCC1)Nc1ccccc1[N+](=O)[O-]
Properties
Complexity:
312
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.091g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
251.242g/mol
Monoisotopic Mass:
251.091g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
87.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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