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Home > Nitro Compounds > 91619-33-9
91619-33-9 | 4-((3-Nitrophenyl);sulfonyl);morpholine
CAS No: 91619-33-9 Catalog No: AG003K1E MDL No:MFCD00622715
Product Description
Catalog Number:
AG003K1E
Chemical Name:
4-((3-Nitrophenyl);sulfonyl);morpholine
CAS Number:
91619-33-9
Molecular Formula:
C10H12N2O5S
Molecular Weight:
272.2777
MDL Number:
MFCD00622715
IUPAC Name:
4-(3-nitrophenyl)sulfonylmorpholine
InChI:
InChI=1S/C10H12N2O5S/c13-12(14)9-2-1-3-10(8-9)18(15,16)11-4-6-17-7-5-11/h1-3,8H,4-7H2
InChI Key:
XCYXNNGNLAIXNM-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc(c1)S(=O)(=O)N1CCOCC1
NSC Number:
41055
Properties
Complexity:
394
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.047g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
272.275g/mol
Monoisotopic Mass:
272.047g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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