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88627-50-3 | Butane, 2-[2-[[2-(2-propenylthio)ethyl]thio]ethoxy]-
CAS No: 88627-50-3 Catalog No: AG004AJH MDL No:
Product Description
Catalog Number:
AG004AJH
Chemical Name:
Butane, 2-[2-[[2-(2-propenylthio)ethyl]thio]ethoxy]-
CAS Number:
88627-50-3
Molecular Formula:
C11H22OS2
Molecular Weight:
234.4218
IUPAC Name:
2-[2-(2-prop-2-enylsulfanylethylsulfanyl)ethoxy]butane
InChI:
InChI=1S/C11H22OS2/c1-4-7-13-9-10-14-8-6-12-11(3)5-2/h4,11H,1,5-10H2,2-3H3
InChI Key:
CFGHJVYTCBFIRP-UHFFFAOYSA-N
SMILES:
C=CCSCCSCCOC(CC)C
Properties
Complexity:
129
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.111g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.416g/mol
Monoisotopic Mass:
234.111g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
59.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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