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1052552-74-5 | N-ethyltetrahydro-3-thiophenamine 1,1-dioxide hydrochloride
CAS No: 1052552-74-5 Catalog No: AG00HAME MDL No:MFCD06671627
Product Description
Catalog Number:
AG00HAME
Chemical Name:
N-ethyltetrahydro-3-thiophenamine 1,1-dioxide hydrochloride
CAS Number:
1052552-74-5
Molecular Formula:
C6H14ClNO2S
Molecular Weight:
199.6989
MDL Number:
MFCD06671627
IUPAC Name:
N-ethyl-1,1-dioxothiolan-3-amine;hydrochloride
InChI:
InChI=1S/C6H13NO2S.ClH/c1-2-7-6-3-4-10(8,9)5-6;/h6-7H,2-5H2,1H3;1H
InChI Key:
YXAPQTQTPBOJKS-UHFFFAOYSA-N
SMILES:
CCNC1CCS(=O)(=O)C1.Cl
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.043g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
199.693g/mol
Monoisotopic Mass:
199.043g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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