2-(Phenylsulfanyl)ethanol

Basic Information

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CAS Number

699-12-7

Molecular Formula

C8H10OS

Molecular Weight

154.23 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Hydrocarbons

Basic Physical Properties

Boiling Point

115-116 °C/2 mmHg

Density

1.143 g/mL at 25 °C

Refractive Index

n20/D 1.592(lit.)

SMILES

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C1=CC=C(C=C1)SCCO

InChI

InChI=1S/C8H10OS/c9-6-7-10-8-4-2-1-3-5-8/h1-5,9H,6-7H2

InChIKey

KWWZHCSQVRVQGF-UHFFFAOYSA-N

LogP

1.771

Topological Polar Surface Area

20.23 Å²

Hydrogen Bond Donor/Acceptor

1 / 1

Complexity

79.3

Safety Information

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Hazard Class

Class STENCH Class STENCH

Synonyms & References

English

beta-phenylthioethyl-alcohol
AKOS005206984
2-phenylsulfanylethanol
D83749
Z149157348
CAS-699-12-7
DTXSID1046974
NCGC00256118-01
NSC 57851
2-(Phenylsulfanyl)ethanol #
NS00036980
2-(Phenylsulfanyl)ethanol
2-Hydroxyethyl phenyl sulfide
J-620011
EINECS 211-828-9
2-(phenylsulfanyl)ethan-1-ol
NSC57851
2-hydroxyethylphenylsulfide
Phenylthioethanol
AI3-17423
CS-W016268
Tox21_301520
FT-0612600
KWWZHCSQVRVQGF-UHFFFAOYSA-
DTXCID9026974
2-Phenylmercaptoethanol
EN300-1241321
NSC-57851
SCHEMBL95988
UNII-9WA374O44P
CHEMBL3185032

MDL Number

MFCD00002905

Customs Code

2942000000

FAQ

What regulatory guidelines apply to 2-(Phenylsulfanyl)ethanol (CAS: 699-12-7)?

2-(Phenylsulfanyl)ethanol (CAS: 699-12-7) is regulated under the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), the Registration, Evaluation, Authorisation and Restriction of Chemicals (REACH) regulations in the EU, and the Toxic Substances Control Act (TSCA) in the US. It is also subject to regulations by the Food and Drug Administration (FDA) and Environmental Protection Agency (EPA) for safety and environmental protection.

Are there alternatives to 2-(Phenylsulfanyl)ethanol (CAS: 699-12-7) in synthesis?

Alternatives to 2-(Phenylsulfanyl)ethanol (CAS: 699-12-7) include 2-(Phenylthio)ethanol analogs such as 2-(methylthio)ethanol and 2-(ethylthio)ethanol. Other substitutes in synthesis may include similar compounds like 2-mercaptoethanol, which can serve as a functional group equivalent.

What is the market or research trend for 2-(Phenylsulfanyl)ethanol (CAS: 699-12-7)?

The market for 2-(Phenylsulfanyl)ethanol (CAS: 699-12-7) shows steady growth driven by its applications in pharmaceuticals, cosmetics, and perfumery. Research trends focus on its properties as a chiral compound and its use in developing new drug molecules. Price trends suggest slight increases due to rising demand and limited supply.

How should waste containing 2-(Phenylsulfanyl)ethanol (CAS: 699-12-7) be handled?

Waste containing 2-(Phenylsulfanyl)ethanol (CAS: 699-12-7) should be collected in properly labeled containers and stored away from ignition sources. It should be disposed of through incineration in specialized facilities or via professional waste disposal services. Environmental protection precautions include monitoring for potential soil and water contamination and adhering to local waste management regulations.