3-Oxatricyclo[4.1.1.02,4]octane,2,7,7-trimethyl-

Modify Date: 2025-08-23 13:16:58

3-Oxatricyclo[4.1.1.02,4]octane,2,7,7-trimethyl- Structure
3-Oxatricyclo[4.1.1.02,4]octane,2,7,7-trimethyl- structure
Common Name 3-Oxatricyclo[4.1.1.02,4]octane,2,7,7-trimethyl-
CAS Number 1686-14-2 Molecular Weight 152.23300
Density 1.027g/cm3 Boiling Point 102 - 103ºC at 30 mm Hg
Molecular Formula C10H16O Melting Point N/A
MSDS Chinese USA Flash Point 65.6ºC

 Use of 3-Oxatricyclo[4.1.1.02,4]octane,2,7,7-trimethyl-


α-Pinene oxide is a natural product that can be isolated from Picea abies (L.) Karst[1].

 Names

Name α-pinene oxide
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.027g/cm3
Boiling Point 102 - 103ºC at 30 mm Hg
Molecular Formula C10H16O
Molecular Weight 152.23300
Flash Point 65.6ºC
Exact Mass 152.12000
PSA 12.53000
LogP 2.20990
Index of Refraction n20/D 1.469(lit.)
InChIKey NQFUSWIGRKFAHK-UHFFFAOYSA-N
SMILES CC1(C)C2CC3OC3(C)C1C2

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TK4565000
CHEMICAL NAME :
Pinane, 2,3-epoxy-
CAS REGISTRY NUMBER :
1686-14-2
BEILSTEIN REFERENCE NO. :
0080362
LAST UPDATED :
199701
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C10-H16-O
MOLECULAR WEIGHT :
152.26

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intramuscular
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
100 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value

MUTATION DATA

TYPE OF TEST :
Sister chromatid exchange
TEST SYSTEM :
Rodent - hamster Lung
DOSE/DURATION :
500 umol/L
REFERENCE :
MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 249,55,1991

 Safety Information

Personal Protective Equipment Eyeshields;Gloves;half-mask respirator (US);multi-purpose combination respirator cartridge (US)
RIDADR NONH for all modes of transport
WGK Germany 3
RTECS TK4565000
HS Code 2932999099

 Synthetic Route

 Customs

HS Code 2932999099
Summary 2932999099. other heterocyclic compounds with oxygen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Articles11

More Articles
Secondary organic aerosol from alpha-pinene ozonolysis in dynamic chamber system.

Indoor Air 19(4) , 335-45, (2009)

The formation of secondary organic aerosol (SOA) produced from alpha-pinene ozonolysis was examined using a dynamic chamber system that allowed the simulation of ventilated indoor environments. Partic...

Improvement of P450(BM-3) whole-cell biocatalysis by integrating heterologous cofactor regeneration combining glucose facilitator and dehydrogenase in E. coli.

Appl. Microbiol. Biotechnol. 78(1) , 55-65, (2008)

Escherichia coli BL21, expressing a quintuple mutant of P450(BM-3), oxyfunctionalizes alpha-pinene in an NADPH-dependent reaction to alpha-pinene oxide, verbenol, and myrtenol. We optimized the whole-...

Optimization of isonovalal production from alpha-pinene oxide using permeabilized cells of Pseudomonas rhodesiae CIP 107491.

Appl. Microbiol. Biotechnol. 60(5) , 534-40, (2003)

Optimization studies on the synthesis of isonovalal from alpha-pinene oxide by Pseudomonas rhodesiae CIP 107491 operated in a biphasic medium are presented. Three key parameters are identified. The fi...

 Synonyms

EINECS 216-869-6
α-Pinene oxide
Alpha-Pinene Oxide
2,3-Epoxypinane
Pinane, 2,3-epoxy-, (-)-
MFCD00066955
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