2- (Hydroxymethyl) thiophene

CAT: 0127-OR59889-01Size: 25 gDry Ice: NoHazardous: No

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CAT#:0127-OR59889-01Size:25 g

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CAS Number

636-72-6

Synonyms

(Thien-2-yl) methanol

MDL Number

MFCD00005454

Purity

99%

Smiles

OCc1cccs1

Storage Conditions

Store at 2-8°C

Chemical Information

2-Thiophenemethanol

2-thiophenemethanol is a metabolite found in or produced by Saccharomyces cerevisiae.

CAS Number	636-72-6
PubChem CID	69467
IUPAC Name	thiophen-2-ylmethanol
Molecular Formula	C5H6OS
Molecular Weight	114.17
XLogP	0.9
Topological Polar Surface Area	48.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	7
Formal Charge	0
Complexity	56

SMILES

C1=CSC(=C1)CO

InChI

InChI=1S/C5H6OS/c6-4-5-2-1-3-7-5/h1-3,6H,4H2

InChIKey

ZPHGMBGIFODUMF-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 636-72-6

CID: 69467

Formula: C5H6OS

MW: 114.17

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	114.17
XLogP3	0.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	114.01393598
Monoisotopic Mass	114.01393598
Topological Polar Surface Area	48.5 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	56
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

Catalog	Name
OR45210-01	2- (Cyclopropyl) -5- (hydroxymethyl) thiophene
OR10141-01	3- (Hydroxymethyl) thiophene
OR77958-01	5- (Hydroxymethyl) thiophene-2-carbonitrile
OR23169	2- (Hydroxymethyl) benzo[b]thiophene
OR1045606-01	4- (Hydroxymethyl) thiophene-2-carboxylic acid
OR23035	2- (Hydroxymethyl) -5- (pyridin-2-yl) thiophene
OR43532-01	7-Bromo-2- (hydroxymethyl) benzo[b]thiophene
PC32363-01	2- (Hydroxymethyl) -4-phenyl-5- (trifluoromethyl) thiophene
OR54348	4-Bromo-2- (hydroxymethyl) benzo[b]thiophene
PC48754-01	7-Fluoro-2- (hydroxymethyl) benzo[b]thiophene

Catalog	Name
229577-01	2- (Hydroxymethyl) thiophene 98+%
VCA26005-01	3-Bromo-4- (hydroxymethyl) thiophene
FAA38124	3- (Hydroxymethyl) benzo[b]thiophene
GEA44927-01	2- (Hydroxymethyl) thiophene-3-carbonitrile
sc-265450	2-Bromo-3-hydroxymethyl-thiophene
AL BD 1052-01	5- (hydroxymethyl) thiophene-2-carboxylic acid
JNB23656-01	Methyl 4- (hydroxymethyl) thiophene-3-carboxylate
CTA97916-01	Methyl 3- (hydroxymethyl) thiophene-2-carboxylate
UJB94783-01	N-[2- (Hydroxymethyl) phenyl]thiophene-2-carboxamide
sc-356314	2- (Hydroxymethyl) -4-phenyl-5- (trifluoromethyl) thiophene