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85391-94-2 | Ethanol,2-[[2-(2-hydroxyethoxy)ethyl]thio]-
CAS No: 85391-94-2 Catalog No: AG004OHH MDL No:MFCD12785326
Product Description
Catalog Number:
AG004OHH
Chemical Name:
Ethanol,2-[[2-(2-hydroxyethoxy)ethyl]thio]-
CAS Number:
85391-94-2
Molecular Formula:
C6H14O3S
Molecular Weight:
166.2386
MDL Number:
MFCD12785326
IUPAC Name:
2-[2-(2-hydroxyethylsulfanyl)ethoxy]ethanol
InChI:
InChI=1S/C6H14O3S/c7-1-3-9-4-6-10-5-2-8/h7-8H,1-6H2
InChI Key:
LXGFOHOXYOCIDT-UHFFFAOYSA-N
SMILES:
OCCOCCSCCO
EC Number:
286-851-0
Properties
Complexity:
61
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.066g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
166.235g/mol
Monoisotopic Mass:
166.066g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
75A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
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