2-Propanol,1,3-dimercapto-

Modify Date: 2025-08-25 11:52:45

2-Propanol,1,3-dimercapto- Structure
2-Propanol,1,3-dimercapto- structure
 Common Name 2-Propanol,1,3-dimercapto-
CAS Number 584-04-3 Molecular Weight 124.22500
Density 1.194g/cm3 Boiling Point 268ºC at 760mmHg
Molecular Formula C3H8OS2 Melting Point N/A
MSDS N/A Flash Point 115.9ºC

 Names

Name 1,3-dimercaptopropan-2-ol
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.194g/cm3
Boiling Point 268ºC at 760mmHg
Molecular Formula C3H8OS2
Molecular Weight 124.22500
Flash Point 115.9ºC
Exact Mass 124.00200
PSA 97.83000
LogP 0.20690
Index of Refraction 1.551
InChIKey WNPSAOYKQQUALV-UHFFFAOYSA-N
SMILES OC(CS)CS

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UB2626000
CHEMICAL NAME :
2-Propanol, 1,3-dimercapto-
CAS REGISTRY NUMBER :
584-04-3
BEILSTEIN REFERENCE NO. :
1732057
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C3-H8-O-S2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Mammal - cat
DOSE/DURATION :
6100 ug/kg
TOXIC EFFECTS :
Behavioral - convulsions or effect on seizure threshold Behavioral - ataxia Lungs, Thorax, or Respiration - respiratory stimulation
REFERENCE :
JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 87(Suppl),6,1946

 Synthetic Route

1,3-Dichloro-2-propanol structure

1,3-Dichloro-2-...

CAS#:96-23-1

~59%

2-Propanol,1,3-dimercapto- Structure

2-Propanol,1,3-...

CAS#:584-04-3

Literature: Zhang, Liangwei; Duan, Dongzhu; Liu, Yaping; Ge, Chunpo; Cui, Xuemei; Sun, Jinyu; Fang, Jianguo Journal of the American Chemical Society, 2014 , vol. 136, # 1 p. 226 - 233
Epichlorohydrin structure

Epichlorohydrin

CAS#:106-89-8

~27%

4-hydroxy-1,2-dithiolane structure

4-hydroxy-1,2-d...

CAS#:27550-66-9

2-Propanol,1,3-dimercapto- Structure

2-Propanol,1,3-...

CAS#:584-04-3

dimercaprol structure

dimercaprol

CAS#:59-52-9

Literature: Levanova; Grabel'nykh; Sukhomazova; Zemirova; Russavskaya; Albanov; Klyba; Zhanchipova; Korchevin Russian Journal of Organic Chemistry, 2008 , vol. 44, # 10 p. 1428 - 1433
4-hydroxy-1,2-dithiolane structure

4-hydroxy-1,2-d...

CAS#:27550-66-9

~%

2-Propanol,1,3-dimercapto- Structure

2-Propanol,1,3-...

CAS#:584-04-3

Literature: Szajewski, Richard P.; Whitesides, George M. Journal of the American Chemical Society, 1980 , vol. 102, # 6 p. 2011 - 2026
1,3-Dibromo-2-propanol structure

1,3-Dibromo-2-p...

CAS#:96-21-9

~%

2-Propanol,1,3-dimercapto- Structure

2-Propanol,1,3-...

CAS#:584-04-3

Literature: Simpson Canadian Journal of Research, Section B: Chemical Sciences, 1947 , vol. 25, p. 25
N/A structure

N/A

CAS#:92939-54-3

~%

2-Propanol,1,3-dimercapto- Structure

2-Propanol,1,3-...

CAS#:584-04-3

Literature: Johary; Owen Journal of the Chemical Society, 1955 , p. 1302,1305
Epichlorohydrin structure

Epichlorohydrin

CAS#:106-89-8

~%

2-Propanol,1,3-dimercapto- Structure

2-Propanol,1,3-...

CAS#:584-04-3

Literature: Adams,E.P. Journal of the Chemical Society, 1960 , p. 2649

 Synonyms

1,3-dimercaptopropan-2ol
1,3-dithio-2-propanol
1,3-dimercapto-2-propanol
1,3-disulfanylpropan-2-ol
1,3-Dimercaptopropanol-2
1,3-dimercaptopropane-2-ol
2-hydroxy-1,3-propanedithiol
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