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24653-46-1 | 2-Butene, 2-methyl-3-(methylthio)-
CAS No: 24653-46-1 Catalog No: AG002OYP MDL No:
Product Description
Catalog Number:
AG002OYP
Chemical Name:
2-Butene, 2-methyl-3-(methylthio)-
CAS Number:
24653-46-1
Molecular Formula:
C6H12S
Molecular Weight:
116.2245
IUPAC Name:
2-methyl-3-methylsulfanylbut-2-ene
InChI:
InChI=1S/C6H12S/c1-5(2)6(3)7-4/h1-4H3
InChI Key:
BFGFLYCZBGDXKT-UHFFFAOYSA-N
SMILES:
CSC(=C(C)C)C
Properties
Complexity:
78.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
116.066g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
116.222g/mol
Monoisotopic Mass:
116.066g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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