1-Propanethiol Structure

1-Propanethiol

Chemical Properties

Melting point -113 °C
Boiling point 67-68 °C(lit.)
Density  0.841 g/mL at 25 °C(lit.)
vapor density  2.54 (vs air)
vapor pressure  122 mm Hg ( 20 °C)
refractive index  n20/D 1.437(lit.)
FEMA  3521 | PROPANETHIOL
FLAVIS Number 12.071 | 1-Propane-1-thiol
Flash point −5 °F
storage temp.  Store below +30°C.
solubility  1.9g/l
form  Liquid
pka pK1:10.86 (25°C)
color  Colorless
Odor at 0.10 % in propylene glycol. cabbage natural gas sweet onion
Odor Type alliaceous
biological source synthetic
Odor Threshold 0.000013ppm
Water Solubility  immiscible
Specific Heat Capacity Cp(liquid): 1.9 J/(g·K), at 25℃
Sensitive  Air Sensitive
JECFA Number 509
BRN  1696860
Henry's Law Constant 1.7×10-3 mol/(m3Pa) at 25℃, Plyasunova et al. (2004)
Exposure limits NIOSH: Ceiling 0.5 ppm(1.6 mg/m3)
InChI 1S/C3H8S/c1-2-3-4/h4H,2-3H2,1H3
InChIKey SUVIGLJNEAMWEG-UHFFFAOYSA-N
SMILES CCCS
LogP 1.7 at 20℃
CAS DataBase Reference 107-03-9(CAS DataBase Reference)
Substances Added to Food (formerly EAFUS) PROPYL MERCAPTAN
FDA 21 CFR 172.515
EWG's Food Scores 1
FDA UNII 4AB0N08V2H
NIST Chemistry Reference 1-Propanethiol(107-03-9)
EPA Substance Registry System 1-Propanethiol (107-03-9)
UNSPSC Code 12352200
NACRES NA.24

Safety

Symbol(GHS) Flame (GHS02)Exclamation Mark (GHS07)Environment (GHS09)
Signal wordDanger
Hazard statements H302-H333-H315-H319-H335-H410-H225
Precautionary statements P501-P261-P273-P270-P240-P210-P233-P243-P241-P242-P271-P264-P280-P370+P378-P391-P337+P313-P305+P351+P338-P362+P364-P303+P361+P353-P332+P313-P301+P312+P330-P304+P340+P312-P403+P233-P403+P235-P405
Hazard Codes  F,Xn,N
Risk Statements  11-22-37/38-41-50-36/37/38-21/22
Safety Statements  16-26-39-57-36/37/39-29
OEL Ceiling: 0.5 ppm (1.6 mg/m3) [15-minute]
RIDADR  UN 2402 (PROPANETHIOLS)
WGK Germany  3
RTECS  TZ7300000
F  13
TSCA  TSCA listed
HazardClass  3
PackingGroup  II
HS Code  29309070
Storage Class 3 - Flammable liquids
Hazard Classifications Acute Tox. 4 Oral
Aquatic Acute 1
Aquatic Chronic 1
Flam. Liq. 2
Skin Sens. 1B
Hazardous Substances Data 107-03-9(Hazardous Substances Data)
Toxicity LD50 orally in Rabbit: 1790 mg/kg
NFPA 704:
3
2 0

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1-Propanethiol Chemical Properties,Usage,Production

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