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2- (2-Hydroxyethyl) thiophene

CAT: 0127-OR6571-01Size: 25 gDry Ice: NoHazardous: No
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CAT#:0127-OR6571-01Size:25 g
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CAS Number
5402-55-1
Synonyms
2- (Thien-2-yl) ethan-1-ol, 1-Hydroxy-2- (thien-2-yl) ethane
MDL Number
MFCD00005462
Purity
=95%
Smiles
OCCc1cccs1

Chemical Information

2-Thiopheneethanol

2-(2-Thienyl)ethanol is a heteroarene.

CAS Number5402-55-1
PubChem CID79400
IUPAC Name2-thiophen-2-ylethanol
Molecular FormulaC6H8OS
Molecular Weight128.19
XLogP1.3
Topological Polar Surface Area48.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count8
Formal Charge0
Complexity65
SMILES
C1=CSC(=C1)CCO
InChI
InChI=1S/C6H8OS/c7-4-3-6-2-1-5-8-6/h1-2,5,7H,3-4H2
InChIKey
VMJOFTHFJMLIKL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Thiopheneethanol
CAS: 5402-55-1
CID: 79400
Formula: C6H8OS
MW: 128.19
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight128.19
XLogP31.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass128.02958605
Monoisotopic Mass128.02958605
Topological Polar Surface Area48.5 Ų
Heavy Atom Count8
Formal Charge0
Complexity65.5
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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