2-Thiophenemethanol

C5H6OSCAS 636-72-6114.16 g/mol

Open in Covalent MOL file
HOS
Alcohol

Properties

Molecular formula
C5H6OS
Molar mass
114.16 g/mol
Exact mass
114.0139 Da
Density
1.2147 g/mL (at 14.5 °C)
Melting point
28–30 °C
Boiling point
207 °C
logP
1.24Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 91 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, P501

Identifiers

CAS number
636-72-6
SMILES
OCc1cccs1
InChIKey
ZPHGMBGIFODUMF-UHFFFAOYSA-N
InChI
InChI=1S/C5H6OS/c6-4-5-2-1-3-7-5/h1-3,6H,4H2

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

7 names
  • 2-(Hydroxymethyl)thiophene
  • 2-Thenyl alcohol
  • 2-Thienylmethanol
  • 2-Thienylmethyl alcohol
  • 2-Thienylcarbinol
  • (Thiophen-2-yl)methanol
  • NSC 89695

Work with 2-Thiophenemethanol

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2-Thiopheneethanol5402-55-160 % similar 2-Thiophenemethanamine27757-85-352 % similar 2-Thiophenemethanethiol6258-63-552 % similar 2-chloromethylThiophene765-50-452 % similar 2-Ethylthiophene872-55-952 % similar 2-Propylthiophene1551-27-548 % similar Thiopheneethanamine30433-91-148 % similar Thiophene-2-acetic acid1918-77-047 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Methoxythiophene16839-97-7 3-Methoxythiophene17573-92-1 2-Methyl-3-furanthiol28588-74-1 Thiophene-3-methanol71637-34-8 Furan-2-ylmethanethiol98-02-2

Elsewhere

PubChem CAS Common Chemistry NIST WebBook