Home Other Building Blocks 3-CHLORO-4-(PHENYLTHIO)TETRAHYDRO-1H-1LAMBDA6-THIOPHENE-1,1-DIONE

3-CHLORO-4-(PHENYLTHIO)TETRAHYDRO-1H-1LAMBDA6-THIOPHENE-1,1-DIONE

CAS No.:
15507-87-6
Catalog Number:
AG00ACWR
Molecular Formula:
C10H11ClO2S2
Molecular Weight:
262.7761
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Product Description
Catalog Number:
AG00ACWR
Chemical Name:
3-CHLORO-4-(PHENYLTHIO)TETRAHYDRO-1H-1LAMBDA6-THIOPHENE-1,1-DIONE
CAS Number:
15507-87-6
Molecular Formula:
C10H11ClO2S2
Molecular Weight:
262.7761
MDL Number:
MFCD00174266
IUPAC Name:
3-chloro-4-phenylsulfanylthiolane 1,1-dioxide
InChI:
InChI=1S/C10H11ClO2S2/c11-9-6-15(12,13)7-10(9)14-8-4-2-1-3-5-8/h1-5,9-10H,6-7H2
InChI Key:
OUQPIAKLCXWCJT-UHFFFAOYSA-N
SMILES:
Cl[C@H]1CS(=O)(=O)C[C@@H]1Sc1ccccc1
Properties
Complexity:
304  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.989g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
262.766g/mol
Monoisotopic Mass:
261.989g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
67.8A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties