3-(o-Propylphenoxy)-1,2-propanediol

Modify Date: 2025-08-20 15:28:31

3-(o-Propylphenoxy)-1,2-propanediol Structure
3-(o-Propylphenoxy)-1,2-propanediol structure
Common Name 3-(o-Propylphenoxy)-1,2-propanediol
CAS Number 63991-78-6 Molecular Weight 210.27000
Density 1.099g/cm3 Boiling Point 361.9ºC at 760mmHg
Molecular Formula C12H18O3 Melting Point N/A
MSDS N/A Flash Point 172.7ºC

 Names

Name N,N'-dicyclohexylethanimidamide

 Chemical & Physical Properties

Density 1.099g/cm3
Boiling Point 361.9ºC at 760mmHg
Molecular Formula C12H18O3
Molecular Weight 210.27000
Flash Point 172.7ºC
Exact Mass 210.12600
PSA 49.69000
LogP 1.37110
Index of Refraction 1.533
InChIKey YDFZDHDSQUITOX-UHFFFAOYSA-N
SMILES CCCc1ccccc1OCC(O)CO

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TZ1134000
CHEMICAL NAME :
1,2-Propanediol, 3-(o-propylphenoxy)-
CAS REGISTRY NUMBER :
63991-78-6
BEILSTEIN REFERENCE NO. :
3264371
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H18-O3
MOLECULAR WEIGHT :
210.30
WISWESSER LINE NOTATION :
Q1YQ1OR B3

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1932 mg/kg
TOXIC EFFECTS :
Peripheral Nerve and Sensation - flaccid paralysis without anesthesia (usually neuromuscular blockage) Behavioral - muscle weakness Lungs, Thorax, or Respiration - other changes
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: 93,470,1948
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