3-Thiopheneethanol


Chemical Name: 3-Thiopheneethanol
CAS Number: 13781-67-4
Product Number: AG0013VL(AGN-PC-0JLUQD)
Synonyms:
MDL No: MFCD00009766
Molecular Formula: C6H8OS
Molecular Weight: 128.1921

Identification/Properties


Properties
BP:
223.612 °C at 760 mmHg
Storage:
2-8℃;
Form:
Liquid
Refractive Index:
n20/D 1.552(lit.)
Computed Properties
Molecular Weight:
128.189g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
128.03g/mol
Monoisotopic Mass:
128.03g/mol
Topological Polar Surface Area:
48.5A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
65.5
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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