2-Thiopheneethanol

HCID 79400
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Basic information

CAS
5402-55-1
Standard SMILES
OCCc1cccs1
InChIKey
VMJOFTHFJMLIKL-UHFFFAOYSA-N
Molecular formula
C6H8OS
Average molar mass
128.19 g/mol
Monoisotopic mass
128.02958588

Overview

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

Names & identifiers

Preferred name
2-Thiopheneethanol
IUPAC
2-thiophen-2-ylethanol
English name
2-Thiopheneethanol
Molecular formula
C6H8OS
Molecular weight
128.19

Names & synonyms

2-Thiopheneethanol5402-55-12-(2-Thienyl)ethanol2-(2-Hydroxyethyl)thiopheneThiophen-2-ethanolEthanol, 2-(2-thienyl)-EINECS 226-452-0NSC 5136DTXSID2063840EC 226-452-0RefChem:483791DTXCID4041573
Show more names
2-THIENYLETHANOL2- thiophenealcohol2-ThiophenylethanolTHIOPHENE-2-ETHYANOL
226-452-0Thiophene-2-ethanol2-(thiophen-2-yl)ethanol2-(THIOPHEN-2-YL)ETHAN-1-OL2-thiophen-2-ylethanol2-THIOPHENETHANOLThiopheneethanolMFCD00005462

Database identifiers

CAS
5402-55-1
PubChem CID
79400
DTXSID
DTXSID2063840
ChEBI
CHEBI:195139
UNII
332ZDU4HDC
EC Number
226-452-0
Nikkaji
J213E

Properties

Computed structural properties

XLogP
1.3
Topological polar surface area
48.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
8

Experimental & physicochemical properties

SpringerMaterials PropertiesSurface tension

Physicochemical properties

Boiling point
108 · 108-109 °C/13 mmHg (lit.)
Density
1.153 g/mL · 1.153 g/mL at 25 °C (lit.)
refractive index
20 · n20/D 1.551(lit.)
Flash point
214 °F · 214 °F
storage temp.
30 °C · Store below +30°C.
solubility
Chloroform (Slightly), Ethyl Acetate (Slightly)

Safety & regulation

GHS classification

GHS Classification · 5 items

This chemical does not meet GHS hazard criteria for 76.5% (13 of 17) of all reports.

Warning

H302 (23.5%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 17 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Regulatory Information · 2 items

Status: Active Update: 21-09-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/12422

2-Thiopheneethanol: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesAcute Tox. 4 (23.5%)

Safety data

F
13
PPE
Eyeshields, Gloves, multi-purpose combination respirator cartridge (US)
wgk
3
tsca
TSCA listed
ridadr
UN 3334
hs_code
29349990

Chemistry & industry

Uses & manufacturing

General Manufacturing Information2-Thiopheneethanol: ACTIVE
Applications · 2 items

Uses2-Thiopheneethanol is a thiophene derivative used in the preparation of oligothiophene isothiocyanates as fluorescent markers for biopolymers. 2-Thiopheneethanol is also used in the preparation of oth er biologically active compounds such as the analgesic Sulfentanyl and the antithrombotic Clopidogrel Hydrogen Sulfate (C587250).

Uses2-Thiopheneethanol, is used as the antithrombotics thiophene chlorine match piperidine intermediates. It is also used as a ticlopidine Intermediate.

Upstream & downstream products

Suppliers100 total

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
INTATRADE GmbH+49 3493/605464 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]

Additional notes

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

Related reactions

70 records
New reaction record

Compound notes

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