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77555-27-2 | 2-(Pyridin-2-ylthio)ethanol
CAS No: 77555-27-2 Catalog No: AG008OVJ MDL No:MFCD00067848
Product Description
Catalog Number:
AG008OVJ
Chemical Name:
2-(Pyridin-2-ylthio)ethanol
CAS Number:
77555-27-2
Molecular Formula:
C7H9NOS
Molecular Weight:
155.2175
MDL Number:
MFCD00067848
IUPAC Name:
2-pyridin-2-ylsulfanylethanol
InChI:
InChI=1S/C7H9NOS/c9-5-6-10-7-3-1-2-4-8-7/h1-4,9H,5-6H2
InChI Key:
VKXCZEICJYQFIT-UHFFFAOYSA-N
SMILES:
OCCSc1ccccn1
Properties
Complexity:
89.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.04g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
155.215g/mol
Monoisotopic Mass:
155.04g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
58.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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