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18068-23-0 | Pentane, 1,1'-[methylenebis(thio)]bis-
CAS No: 18068-23-0 Catalog No: AG00227X MDL No:
Product Description
Catalog Number:
AG00227X
Chemical Name:
Pentane, 1,1'-[methylenebis(thio)]bis-
CAS Number:
18068-23-0
Molecular Formula:
C11H24S2
Molecular Weight:
220.4383
IUPAC Name:
1-(pentylsulfanylmethylsulfanyl)pentane
InChI:
InChI=1S/C11H24S2/c1-3-5-7-9-12-11-13-10-8-6-4-2/h3-11H2,1-2H3
InChI Key:
VTPFGSBSDNEPMS-UHFFFAOYSA-N
SMILES:
CCCCCSCSCCCCC
Properties
Complexity:
74.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.132g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.433g/mol
Monoisotopic Mass:
220.132g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
50.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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