Home Other Building Blocks 2-(thian-4-yloxy)ethan-1-ol

2-(thian-4-yloxy)ethan-1-ol

CAS No.:
113194-34-6
Catalog Number:
AG01C77Z
Molecular Formula:
C7H14O2S
Molecular Weight:
162.2499
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Product Description
Catalog Number:
AG01C77Z
Chemical Name:
2-(thian-4-yloxy)ethan-1-ol
CAS Number:
113194-34-6
Molecular Formula:
C7H14O2S
Molecular Weight:
162.2499
IUPAC Name:
2-(thian-4-yloxy)ethanol
InChI:
InChI=1S/C7H14O2S/c8-3-4-9-7-1-5-10-6-2-7/h7-8H,1-6H2
InChI Key:
TVABKCGUYLAMEX-UHFFFAOYSA-N
SMILES:
OCCOC1CCSCC1
Properties
Complexity:
81.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.071g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
162.247g/mol
Monoisotopic Mass:
162.071g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
54.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties