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Home > Nitro Compounds > 845729-41-1

845729-41-1

845729-41-1 | 4-(2-nitrophenyl)Morpholin-3-one

CAS No: 845729-41-1 Catalog No: AG00G3MS MDL No:

Product Description

Catalog Number:
AG00G3MS
Chemical Name:
4-(2-nitrophenyl)Morpholin-3-one
CAS Number:
845729-41-1
Molecular Formula:
C10H10N2O4
Molecular Weight:
222.1974
IUPAC Name:
4-(2-nitrophenyl)morpholin-3-one
InChI:
InChI=1S/C10H10N2O4/c13-10-7-16-6-5-11(10)8-3-1-2-4-9(8)12(14)15/h1-4H,5-7H2
InChI Key:
OXVFGUUCIPAZSM-UHFFFAOYSA-N
SMILES:
O=C1COCCN1c1ccccc1[N+](=O)[O-]

Properties

Complexity:
289  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.064g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.2g/mol
Monoisotopic Mass:
222.064g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
75.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  

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