Home Other Building Blocks 7,7-dimethyl-1,4-thiazepane 1,1-dioxide hydrochloride

7,7-dimethyl-1,4-thiazepane 1,1-dioxide hydrochloride

CAS No.:
1787855-34-8
Catalog Number:
AG01BF58
Molecular Formula:
C7H16ClNO2S
Molecular Weight:
213.7254
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Product Description
Catalog Number:
AG01BF58
Chemical Name:
7,7-dimethyl-1,4-thiazepane 1,1-dioxide hydrochloride
CAS Number:
1787855-34-8
Molecular Formula:
C7H16ClNO2S
Molecular Weight:
213.7254
MDL Number:
MFCD28118493
IUPAC Name:
7,7-dimethyl-1,4-thiazepane 1,1-dioxide;hydrochloride
InChI:
InChI=1S/C7H15NO2S.ClH/c1-7(2)3-4-8-5-6-11(7,9)10;/h8H,3-6H2,1-2H3;1H
InChI Key:
SKRLWGMYVOOHPM-UHFFFAOYSA-N
SMILES:
CC1(C)CCNCCS1(=O)=O.Cl
Properties
Complexity:
225  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.059g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
213.72g/mol
Monoisotopic Mass:
213.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties