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Home > Fluorides > 1820666-22-5
1820666-22-5 | "N-(2,2,2-trifluoroethyl)-1,4-diazepane-1-sulfonamide hydrochloride"
CAS No: 1820666-22-5 Catalog No: AG01FN2G MDL No:MFCD28369756
Product Description
Catalog Number:
AG01FN2G
Chemical Name:
"N-(2,2,2-trifluoroethyl)-1,4-diazepane-1-sulfonamide hydrochloride"
CAS Number:
1820666-22-5
Molecular Formula:
C7H15ClF3N3O2S
Molecular Weight:
297.7261
MDL Number:
MFCD28369756
IUPAC Name:
N-(2,2,2-trifluoroethyl)-1,4-diazepane-1-sulfonamide;hydrochloride
InChI:
InChI=1S/C7H14F3N3O2S.ClH/c8-7(9,10)6-12-16(14,15)13-4-1-2-11-3-5-13;/h11-12H,1-6H2;1H
InChI Key:
SINZKOITNMNMJX-UHFFFAOYSA-N
SMILES:
FC(CNS(=O)(=O)N1CCNCCC1)(F)F.Cl
Properties
Complexity:
312
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.053g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
297.721g/mol
Monoisotopic Mass:
297.053g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
69.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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