CID 39362116
PubChem CID
39362116
Structure
Molecular Formula
Status
Non-live
Molecular Weight
262.30 g/mol
Dates
- Create:2009-05-29
Chemical Structure Depiction
N-[(2R)-2-aminooxypropyl]-4-fluoro-2-methylbenzenesulfonamide
InChI=1S/C10H15FN2O3S/c1-7-5-9(11)3-4-10(7)17(14,15)13-6-8(2)16-12/h3-5,8,13H,6,12H2,1-2H3/t8-/m1/s1
QYRNNNPRJZKFIX-MRVPVSSYSA-N
CC1=C(C=CC(=C1)F)S(=O)(=O)NC[C@@H](C)ON
C10H15FN2O3S
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
262.30 g/mol
Property Name
XLogP3-AA
Property Value
0.9
Property Name
Hydrogen Bond Donor Count
Property Value
2
Property Name
Hydrogen Bond Acceptor Count
Property Value
6
Property Name
Rotatable Bond Count
Property Value
5
Property Name
Exact Mass
Property Value
262.07874168 g/mol
Property Name
Monoisotopic Mass
Property Value
262.07874168 g/mol
Property Name
Topological Polar Surface Area
Property Value
89.8 A^2
Property Name
Heavy Atom Count
Property Value
17
Property Name
Formal Charge
Property Value
0
Property Name
Complexity
Property Value
331
Property Name
Isotope Atom Count
Property Value
0
Property Name
Defined Atom Stereocenter Count
Property Value
1
Property Name
Undefined Atom Stereocenter Count
Property Value
0
Property Name
Defined Bond Stereocenter Count
Property Value
0
Property Name
Undefined Bond Stereocenter Count
Property Value
0
Property Name
Covalently-Bonded Unit Count
Property Value
1
Property Name
Compound Is Canonicalized
Property Value
Yes
Old substance
Old substance
CONTENTS