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Home > Nitro Compounds > 1325065-26-6
1325065-26-6 | 1-(2-methoxy-5-nitrobenzenesulfonyl)pyrrolidine
CAS No: 1325065-26-6 Catalog No: AG01BF71 MDL No:MFCD17572904
Product Description
Catalog Number:
AG01BF71
Chemical Name:
1-(2-methoxy-5-nitrobenzenesulfonyl)pyrrolidine
CAS Number:
1325065-26-6
Molecular Formula:
C11H14N2O5S
Molecular Weight:
286.3043
MDL Number:
MFCD17572904
IUPAC Name:
1-(2-methoxy-5-nitrophenyl)sulfonylpyrrolidine
InChI:
InChI=1S/C11H14N2O5S/c1-18-10-5-4-9(13(14)15)8-11(10)19(16,17)12-6-2-3-7-12/h4-5,8H,2-3,6-7H2,1H3
InChI Key:
HZOLXAZFSIJXGC-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1S(=O)(=O)N1CCCC1)[N+](=O)[O-]
Properties
Complexity:
421
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.062g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
286.302g/mol
Monoisotopic Mass:
286.062g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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