Home Halogens methyl 3-(acetylsulfanyl)-2-chloropropanoate

methyl 3-(acetylsulfanyl)-2-chloropropanoate

CAS No.:
32371-92-9
Catalog Number:
AG01ELT1
Molecular Formula:
C6H9ClO3S
Molecular Weight:
196.6519
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Product Description
Catalog Number:
AG01ELT1
Chemical Name:
methyl 3-(acetylsulfanyl)-2-chloropropanoate
CAS Number:
32371-92-9
Molecular Formula:
C6H9ClO3S
Molecular Weight:
196.6519
MDL Number:
MFCD03005238
IUPAC Name:
methyl 3-acetylsulfanyl-2-chloropropanoate
InChI:
InChI=1S/C6H9ClO3S/c1-4(8)11-3-5(7)6(9)10-2/h5H,3H2,1-2H3
InChI Key:
RSIHVSLHPYRNDL-UHFFFAOYSA-N
SMILES:
COC(=O)C(CSC(=O)C)Cl
NSC Number:
516386
Properties
Complexity:
160  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.996g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.645g/mol
Monoisotopic Mass:
195.996g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
68.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties