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143771-05-5 | 1-Propanol, 3,3'-[methylenebis(thio)]bis- (9CI)
CAS No: 143771-05-5 Catalog No: AG001ID2 MDL No:
Product Description
Catalog Number:
AG001ID2
Chemical Name:
1-Propanol, 3,3'-[methylenebis(thio)]bis- (9CI)
CAS Number:
143771-05-5
Molecular Formula:
C7H16O2S2
Molecular Weight:
196.3307
IUPAC Name:
3-(3-hydroxypropylsulfanylmethylsulfanyl)propan-1-ol
InChI:
InChI=1S/C7H16O2S2/c8-3-1-5-10-7-11-6-2-4-9/h8-9H,1-7H2
InChI Key:
LTXRPFGDTYMYDS-UHFFFAOYSA-N
SMILES:
OCCCSCSCCCO
Properties
Complexity:
63.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.059g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
196.323g/mol
Monoisotopic Mass:
196.059g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
91.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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