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2-Chloroethyl Ethyl Sulfide

CAS No.:
693-07-2
Catalog Number:
AG003H2B
Molecular Formula:
C4H9ClS
Molecular Weight:
124.6323
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Product Description
Catalog Number:
AG003H2B
Chemical Name:
2-Chloroethyl Ethyl Sulfide
CAS Number:
693-07-2
Molecular Formula:
C4H9ClS
Molecular Weight:
124.6323
MDL Number:
MFCD00000979
IUPAC Name:
1-chloro-2-ethylsulfanylethane
InChI:
InChI=1S/C4H9ClS/c1-2-6-4-3-5/h2-4H2,1H3
InChI Key:
GBNVXYXIRHSYEG-UHFFFAOYSA-N
SMILES:
ClCCSCC
EC Number:
211-742-1
UNII:
5MN267Q6RG
NSC Number:
10977
Properties
Complexity:
23.5  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
124.011g/mol
Formal Charge:
0
Heavy Atom Count:
6  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
124.626g/mol
Monoisotopic Mass:
124.011g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Literature
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Properties