[2-(hydroxymethyl)-2-methylpentyl] N,N-diethylcarbamate

Modify Date: 2025-09-20 23:02:04

[2-(hydroxymethyl)-2-methylpentyl] N,N-diethylcarbamate Structure
[2-(hydroxymethyl)-2-methylpentyl] N,N-diethylcarbamate structure
 Common Name [2-(hydroxymethyl)-2-methylpentyl] N,N-diethylcarbamate
CAS Number 26345-29-9 Molecular Weight 231.33200
Density 0.984g/cm3 Boiling Point 325.7ºC at 760 mmHg
Molecular Formula C12H25NO3 Melting Point N/A
MSDS N/A Flash Point 150.8ºC

 Names

Name [2-(hydroxymethyl)-2-methylpentyl] N,N-diethylcarbamate
Synonym More Synonyms

 Chemical & Physical Properties

Density 0.984g/cm3
Boiling Point 325.7ºC at 760 mmHg
Molecular Formula C12H25NO3
Molecular Weight 231.33200
Flash Point 150.8ºC
Exact Mass 231.18300
PSA 49.77000
LogP 2.26350
Vapour Pressure 1.74E-05mmHg at 25°C
Index of Refraction 1.462
InChIKey JFDODGJIADCKIE-UHFFFAOYSA-N
SMILES CCCC(C)(CO)COC(=O)N(CC)CC

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
EZ6940000
CHEMICAL NAME :
Carbamic acid, diethyl-, 2-(hydroxymethyl)-2-methylpentyl ester
CAS REGISTRY NUMBER :
26345-29-9
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H25-N-O3
MOLECULAR WEIGHT :
231.38

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
420 mg/kg
TOXIC EFFECTS :
Autonomic Nervous System - smooth muscle relaxant (mechanism undefined, spasmolytic)
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 12,462,1969

 Synonyms

Carbamic acid,diethyl-,2-(hydroxymethyl)-2-methylpentyl ester
2-Methyl-2-propyl-3-diethylcarbamoyloxy-propanol-(1)
Diethylcarbamic acid 2-(hydroxymethyl)-2-methylpentyl ester
2-(hydroxymethyl)-2-methylpentyl diethylcarbamate
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Chemsrc provides CAS#:26345-29-9 MSDS, density, melting point, boiling point, structure, etc. Its name is [2-(hydroxymethyl)-2-methylpentyl] N,N-diethylcarbamate>> amp version: [2-(hydroxymethyl)-2-methylpentyl] N,N-diethylcarbamate

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