2-Butyl-2-methyl-1,3-dioxolane-4-methanol

Modify Date: 2025-10-01 09:13:05

2-Butyl-2-methyl-1,3-dioxolane-4-methanol Structure
2-Butyl-2-methyl-1,3-dioxolane-4-methanol structure
 Common Name 2-Butyl-2-methyl-1,3-dioxolane-4-methanol
CAS Number 5694-76-8 Molecular Weight 174.23700
Density 0.976g/cm3 Boiling Point 240.5ºC at 760 mmHg
Molecular Formula C9H18O3 Melting Point N/A
MSDS N/A Flash Point 114.9ºC

 Names

Name (2-butyl-2-methyl-1,3-dioxolan-4-yl)methanol
Synonym More Synonyms

 Chemical & Physical Properties

Density 0.976g/cm3
Boiling Point 240.5ºC at 760 mmHg
Molecular Formula C9H18O3
Molecular Weight 174.23700
Flash Point 114.9ºC
Exact Mass 174.12600
PSA 38.69000
LogP 1.30050
Index of Refraction 1.434
InChIKey ZQWSMVNUPDUGRL-UHFFFAOYSA-N
SMILES CCCCC1(C)OCC(CO)O1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
JH8925000
CHEMICAL NAME :
1,3-Dioxolane-4-methanol, 2-butyl-2-methyl-
CAS REGISTRY NUMBER :
5694-76-8
BEILSTEIN REFERENCE NO. :
0106677
LAST UPDATED :
199712
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C9-H18-O3
MOLECULAR WEIGHT :
174.27
WISWESSER LINE NOTATION :
T5O COTJ B4 B1 D1Q

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 :
475 mg/kg
TOXIC EFFECTS :
Peripheral Nerve and Sensation - flaccid paralysis without anesthesia (usually neuromuscular blockage)
REFERENCE :
AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium) V.4- 1898- Volume(issue)/page/year: 85,474,1951

 Precursor & DownStream

Precursor  2

DownStream  0

 Synonyms

2-butyl-2-methyl-4-hydroxymethyl-1,3-dioxolane
2-Butyl-2-methyl-1,3-dioxolane-4-methanol
1,3-DIOXOLANE-4-METHANOL,2-BUTYL-2-METHYL
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Chemsrc provides CAS#:5694-76-8 MSDS, density, melting point, boiling point, structure, etc. Its name is 2-Butyl-2-methyl-1,3-dioxolane-4-methanol>> amp version: 2-Butyl-2-methyl-1,3-dioxolane-4-methanol

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