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866042-41-3

866042-41-3 | 1,1,1-trifluoro-N-[(2Z)-piperidin-2-ylidene]methanesulfonamide

CAS No: 866042-41-3 Catalog No: AG00ITBP MDL No:MFCD05670541

Product Description

Catalog Number:
AG00ITBP
Chemical Name:
1,1,1-trifluoro-N-[(2Z)-piperidin-2-ylidene]methanesulfonamide
CAS Number:
866042-41-3
Molecular Formula:
C6H9F3N2O2S
Molecular Weight:
230.2081
MDL Number:
MFCD05670541
IUPAC Name:
1,1,1-trifluoro-N-(2,3,4,5-tetrahydropyridin-6-yl)methanesulfonamide
InChI:
InChI=1S/C6H9F3N2O2S/c7-6(8,9)14(12,13)11-5-3-1-2-4-10-5/h1-4H2,(H,10,11)
InChI Key:
FXNDYPRGVCBXSY-UHFFFAOYSA-N
SMILES:
O=S(=O)(C(F)(F)F)/N=C\1/CCCCN1

Properties

Complexity:
328  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.034g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
230.205g/mol
Monoisotopic Mass:
230.034g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  

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