2-Butanethiol | CAS No. 513-53-1

2-Butanethiol

Basic Information

CAS Number

513-53-1

Molecular Formula

C4H10S

Molecular Weight

90.19 g/mol

EINECS

208-165-2

AD

Basic Physical Properties

Physical State

Colorless to Almost colorless

Melting Point

-165°

Boiling Point

84.6-85.2°C

Density

0.83g/mLat 25°C

Flash Point

70°F

Solubility

1.32g/l

Refractive Index

n20/D 1.436(lit.)

Vapor Pressure

142 mm Hg ( 37.7 °C)

Odor Threshold

0.00003ppm

CCC(C)S

InChI

InChI=1S/C4H10S/c1-3-4(2)5/h4-5H,3H2,1-2H3

InChIKey

LOCHFZBWPCLPAN-UHFFFAOYSA-N

LogP

1.7147

pKa

10.92±0.10(Predicted)

Topological Polar Surface Area

0.0 Ų

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

19.6

Safety Information

View Safety Information

GHS Hazard Pictograms

H225H225
H315H315
H319H319
H335H335

Hazard Statement

H225 Highly Flammable liquid and vapor
Flammable liquids
H315 Causes skin irritation
Skin corrosion/irritation
H319 Causes serious eye irritation
Serious eye damage/eye irritation
H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Hazard Class

Class 3.1 Class 3.1

Explosive Limit

1.7-9.6%(V)

Toxicity

LD50 orally in Rabbit: 5176 mg/kg LD50 dermal Rabbit > 2000 mg/kg

Synonyms & References

English

  • 2-BUTANETHIOL 98+%
  • SEC-BUTYL MERCAPTAN 93+%
  • S-Butanethiol
  • Butan-2-thiol
  • 1-METHYL-1-PROPANETHIOL 98%
  • sec-Butyl mercaptan, Mercaptan C4
  • Inchi=1/C4H10S/C1-3-4(2)5/H4-5H,3H2,1-2h
  • 2-BUTANETHIOL FOR SYNTHESIS 5 ML
  • 2-butanethiol
  • 1-methyl-1-propanethiol
  • Butylmercaptan
  • sec-Butyl mercaptan
  • (+/-)-1-METHYL-1-PROPANETHIOL
  • 1-methylpropane-1-thiol
  • 1-methylpropanethiol
  • 2-mercaptobutane
  • butane-2-thiol
  • sec-Butyl mercaptan,Mercaptan C4
  • (?à)-2-Butanethiol
  • 2-Butyl mercaptan
  • 3-Methyl-2-propanethiol
  • NSC 78417
  • s-Butyl mercaptan
  • sec-Butanethiol
  • sec-Butyl thioalcohol
  • sec-Butylthiol
  • 2-Butanethiol
  • 1-Methyl-1-propanethiol
  • 2-Mercaptobutane

MDL Number

MFCD00004865

EC Number

208-165-2

Customs Code

29309070

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