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19284-68-5 | Butane, 1-[(2,2-dichloroethenyl)thio]-
CAS No: 19284-68-5 Catalog No: AG002GEU MDL No:
Product Description
Catalog Number:
AG002GEU
Chemical Name:
Butane, 1-[(2,2-dichloroethenyl)thio]-
CAS Number:
19284-68-5
Molecular Formula:
C6H10Cl2S
Molecular Weight:
185.1146
IUPAC Name:
1-(2,2-dichloroethenylsulfanyl)butane
InChI:
InChI=1S/C6H10Cl2S/c1-2-3-4-9-5-6(7)8/h5H,2-4H2,1H3
InChI Key:
WTQIGXPRHOHMDX-UHFFFAOYSA-N
SMILES:
CCCCSC=C(Cl)Cl
Properties
Complexity:
87.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.988g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
185.106g/mol
Monoisotopic Mass:
183.988g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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