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Substance Name: Propyl mercaptan
RN: 107-03-9
UNII: 4AB0N08V2H
InChIKey: SUVIGLJNEAMWEG-UHFFFAOYSA-N
Classification Code
- Skin / Eye Irritant
Molecular Formula
- C3-H8-S
Molecular Weight
- 76.1622
- All
- Links to Resources
- Names & Synonyms
- Registry Numbers
- Structure Descriptors
- Toxicity
- Physical Properties
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Names and Synonyms
Name of Substance
- Propanethiol
- Propyl mercaptan
Synonyms
- 1-Mercaptopropane
- 1-Propyl mercaptan
- 1-Propylmercaptan
- 4-01-00-01449 (Beilstein Handbook Reference)
- BRN 1696860
- CCRIS 1246
- EINECS 203-455-5
- FEMA No. 3521
- HSDB 1037
- n-Propyl mercaptan
- n-Propylmercaptan
- n-Propylthiol
- n-Thiopropyl alcohol
- Propane-1-thiol
- Propanethiol
- Propyl mercaptan
- Propylthiol
- Thiopropyl alcohol
- UNII-4AB0N08V2H
Systematic Name
- 1-Propanethiol
Superlist Names
- 1-Propanethiol
- n-Propyl mercaptan
- Propanethiol
- Propyl mercaptan
Registry Numbers
CAS Registry Number
- 107-03-9
FDA UNII
- 4AB0N08V2H
Related Registry Number
- 6898-84-6 (hydrochloride salt)
System Generated Number
- 0000107039
Structure Descriptors
InChI
InChI=1S/C3H8S/c1-2-3-4/h4H,2-3H2,1H3InChIKey
SUVIGLJNEAMWEG-UHFFFAOYSA-NSmiles
CCCSToxicity
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LC50 | inhalation | 4010ppm/4H (4010ppm) | SENSE ORGANS AND SPECIAL SENSES: CHROMODACYRORREA: EYE BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION | American Industrial Hygiene Association Journal. Vol. 19, Pg. 171, 1958. |
rat | LC50 | inhalation | 7300ppm/4H (7300ppm) | BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) SENSE ORGANS AND SPECIAL SENSES: LACRIMATION: EYE LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION | American Industrial Hygiene Association Journal. Vol. 19, Pg. 171, 1958. |
rat | LD50 | intraperitoneal | 515mg/kg (515mg/kg) | BEHAVIORAL: COMA LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) | American Industrial Hygiene Association Journal. Vol. 19, Pg. 171, 1958. |
rat | LD50 | oral | 1790mg/kg (1790mg/kg) | BEHAVIORAL: COMA BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION | American Industrial Hygiene Association Journal. Vol. 19, Pg. 171, 1958. |
Physical Properties
Physical Property | Value | Units | Temp (deg C) | Source |
---|---|---|---|---|
Melting Point | -1.13E+02 | deg C | EXP | |
Boiling Point | 67.8 | deg C | EXP | |
log P (octanol-water) | 1.81 | (none) | EXP | |
Water Solubility | 1900 | mg/L | 25 | EXP |
Vapor Pressure | 154 | mm Hg | 25 | EXP |
Henry's Law Constant | 8.12E-03 | atm-m3/mole | 25 | EST |
Atmospheric OH Rate Constant | 4.83E-11 | cm3/molecule-sec | 25 | EXP |
Physical property data is provided to ChemIDplus by SRC, Inc.