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2-Thiopheneethanol(CAS No. 5402-55-1)

2-Thiopheneethanol C6H8OS (cas 5402-55-1) Molecular Structure

5402-55-1 Structure

Identification and Related Records

【Name】
2-Thiopheneethanol
【Iupac name】
2-thiophen-2-ylethanol
【CAS Registry number】
5402-55-1
【Synonyms】
2-(2-Hydroxyethyl)thiofuran
2-(2-Hydroxyethyl)thiophene
2-(2-Thienyl)-1-ethanol
2-(2-Thienyl)ethanol
2-(Thiophen-2-yl)ethanol
NSC 5136
thiophene-2- ethanol
Thiophene-2-Ethanol
【EINECS(EC#)】
226-452-0
【Molecular Formula】
C6H8OS (Products with the same molecular formula)
【Molecular Weight】
128.19
【Inchi】
InChI=1/C6H8OS/c7-4-3-6-2-1-5-8-6/h1-2,5,7H,3-4H2
【InChIKey】
VMJOFTHFJMLIKL-UHFFFAOYSA-N
【Canonical SMILES】
C1=CSC(=C1)CCO
【MOL File】
5402-55-1.mol

Chemical and Physical Properties

【Appearance】
clear colorless to slight colored liquid
【Density】
1.153
【Boiling Point】
108℃ (13 mmHg)
【Refractive Index】
1.549-1.552
【Flash Point】
101℃
【Water】
slightly soluble
【Solubilities】
slightly soluble
【Stability】
Stable under normal temperatures and pressures.
【HS Code】
29349990
【Storage temp】
Keep away from heat, sparks, and flame. Keep away from sources of ignition. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.
【Computed Properties】
Molecular Weight:128.19212 [g/mol]
Molecular Formula:C6H8OS
XLogP3:1.3
H-Bond Donor:1
H-Bond Acceptor:2
Rotatable Bond Count:2
Exact Mass:128.029586
MonoIsotopic Mass:128.029586
Topological Polar Surface Area:48.5
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
Feature 3D Acceptor Count:1
Feature 3D Donor Count:1
Feature 3D Ring Count:1
Effective Rotor Count:2
Conformer Sampling RMSD:0.4
CID Conformer Count:12

Safety and Handling

【Hazard Codes】
Xi: Irritant;
【Risk Statements】
R36/37/38
【Safety Statements 】
S23;S24/25
【Hazard Note】

Irritant

【Safety】

Safty information about 2-Thiopheneethanol (CAS NO.5402-55-1) is:
Hazard Codes:?IrritantXi
Risk Statements: 36/37/38?
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 23-24/25-36-26?
S23:Do not breathe vapour.?
S24/25:Avoid contact with skin and eyes.?
S36:Wear suitable protective clothing.?
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
WGK Germany: 3
F: 13
Hazard Note: Irritant
HS Code: 29349990

【Transport】
200kgs
【Specification】

?2-Thiopheneethanol , its cas register number is 5402-55-1. It also can be called?2-(2-Hydroxyethyl)thiophene ; 2-(2-Thienyl)ethanol ; Ethanol, 2-(2-thienyl)- ; Thiophen-2-ethanol .It is a?clear colorless to slight colored liquid.
?

Supplier Location

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Diamond member Hangzhou Dayangchem Co., Ltd.
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Telephone:86-571-87396430
Hui Chem Company Limited
Country:ChinaChina
Business Type:Manufacturer
Telephone:86-21-60542966

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