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73448-74-5

73448-74-5 | Methyl 2-[(2,4-Dichlorophenyl)thio]-acetate

CAS No: 73448-74-5 Catalog No: AG01FB3V MDL No:MFCD25976513

Product Description

Catalog Number:
AG01FB3V
Chemical Name:
Methyl 2-[(2,4-Dichlorophenyl)thio]-acetate
CAS Number:
73448-74-5
Molecular Formula:
C9H8Cl2O2S
Molecular Weight:
251.1296
MDL Number:
MFCD25976513
IUPAC Name:
methyl 2-(2,4-dichlorophenyl)sulfanylacetate
InChI:
InChI=1S/C9H8Cl2O2S/c1-13-9(12)5-14-8-3-2-6(10)4-7(8)11/h2-4H,5H2,1H3
InChI Key:
RGYJRYPDJXDZTA-UHFFFAOYSA-N
SMILES:
COC(=O)CSc1ccc(cc1Cl)Cl

Properties

Complexity:
201  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.962g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
251.121g/mol
Monoisotopic Mass:
249.962g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
51.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  

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