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102145-09-5 | 1,3-Dioxolane, 2-methyl-2-[1-methyl-2-(pentylthio)ethyl]-
CAS No: 102145-09-5 Catalog No: AG0006QM MDL No:
Product Description
Catalog Number:
AG0006QM
Chemical Name:
1,3-Dioxolane, 2-methyl-2-[1-methyl-2-(pentylthio)ethyl]-
CAS Number:
102145-09-5
Molecular Formula:
C12H24O2S
Molecular Weight:
232.3828
IUPAC Name:
2-methyl-2-(1-pentylsulfanylpropan-2-yl)-1,3-dioxolane
InChI:
InChI=1S/C12H24O2S/c1-4-5-6-9-15-10-11(2)12(3)13-7-8-14-12/h11H,4-10H2,1-3H3
InChI Key:
ARSVPDJWXYJXJS-UHFFFAOYSA-N
SMILES:
CCCCCSCC(C1(C)OCCO1)C
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.15g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
232.382g/mol
Monoisotopic Mass:
232.15g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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