Home Aminos 4-[(2,2-difluoroethyl)amino]-1lambda6-thiane-1,1-dione hydrochloride

4-[(2,2-difluoroethyl)amino]-1lambda6-thiane-1,1-dione hydrochloride

CAS No.:
1798779-21-1
Catalog Number:
AG01BFIY
Molecular Formula:
C7H14ClF2NO2S
Molecular Weight:
249.7064
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Product Description
Catalog Number:
AG01BFIY
Chemical Name:
4-[(2,2-difluoroethyl)amino]-1lambda6-thiane-1,1-dione hydrochloride
CAS Number:
1798779-21-1
Molecular Formula:
C7H14ClF2NO2S
Molecular Weight:
249.7064
MDL Number:
MFCD28118613
IUPAC Name:
N-(2,2-difluoroethyl)-1,1-dioxothian-4-amine;hydrochloride
InChI:
InChI=1S/C7H13F2NO2S.ClH/c8-7(9)5-10-6-1-3-13(11,12)4-2-6;/h6-7,10H,1-5H2;1H
InChI Key:
WLQXEVNTVMABRC-UHFFFAOYSA-N
SMILES:
FC(CNC1CCS(=O)(=O)CC1)F.Cl
Properties
Complexity:
234  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.04g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
249.701g/mol
Monoisotopic Mass:
249.04g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties