Home Aminos 4-amino-3,4-dihydro-2H-1lambda6-benzothiopyran-1,1-dione hydrochloride

4-amino-3,4-dihydro-2H-1lambda6-benzothiopyran-1,1-dione hydrochloride

CAS No.:
7585-63-9
Catalog Number:
AG00G445
Molecular Formula:
C9H12ClNO2S
Molecular Weight:
233.7151
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Product Description
Catalog Number:
AG00G445
Chemical Name:
4-amino-3,4-dihydro-2H-1lambda6-benzothiopyran-1,1-dione hydrochloride
CAS Number:
7585-63-9
Molecular Formula:
C9H12ClNO2S
Molecular Weight:
233.7151
MDL Number:
MFCD07838334
IUPAC Name:
1,1-dioxo-3,4-dihydro-2H-thiochromen-4-amine;hydrochloride
InChI:
InChI=1S/C9H11NO2S.ClH/c10-8-5-6-13(11,12)9-4-2-1-3-7(8)9;/h1-4,8H,5-6,10H2;1H
InChI Key:
GKPLTSUHDQQPNM-UHFFFAOYSA-N
SMILES:
NC1CCS(=O)(=O)c2c1cccc2.Cl
Properties
Complexity:
281  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.028g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
233.71g/mol
Monoisotopic Mass:
233.028g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
68.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties