 Home > Encyclopedia > α-Cedrene epoxide

α-Cedrene epoxide

α-Cedrene epoxide structure

CAS No:
29597-36-2
Formula:
C15H24O
Chemical Name:
α-Cedrene epoxide
Synonyms:
2H-2a,7-Methanoazuleno[5,6-b]oxirene,octahydro-3,6,6,7a-tetramethyl-;8ξ-Cedrane,8,9-epoxy-;1H-3a,7-Methanoazulene,5,6-epoxyoctahydro-3,6,8,8-tetramethyl-;Octahydro-3,6,6,7a-tetramethyl-2H-2a,7-methanoazuleno[5,6-b]oxirene;α-Epoxycedrene;α-Cedrene epoxide;NSC 371728;Andrane;2,6,6,8-Tetramethyl-9-oxatetracyclo[5.4.1.0[1,5].0[8,10]]dodecane;1789709-51-8
Categories:
Organic Chemistry > Hydrocarbons and Derivatives

Request for Quotation

Description

Alpha-Cedrene epoxide is a cedrane sesquiterpenoid.

α-Cedrene epoxide Basic Attributes

Molecular Weight：

220.35

Exact Mass：

220.35

EC Number：

249-717-2

NSC Number：

371728

DSSTox ID：

DTXSID1051692

HScode：

2932999099

Characteristics

PSA：

12.5

XLogP3：

4.17

Density：

1.0±0.1 g/cm3

Boiling Point：

269.4±8.0 °C at 760 mmHg

Flash Point：

98.4±15.3 °C

Refractive Index：

1.531

Toxicity：

Oral-rat LD50: > 5000 mg/kg

Flammability characteristics：

Thermal decomposition spicy irritating smoke

Safety Information

Storage features：

The warehouse is low-temperature, ventilated and dry

Precautionary statement(s)：

P264, P280, P302+P352, P321, P332+P313, P362

Hazard Statements：

H315

GHS Classification：

Not Classified| |Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P264, P280, P302+P352, P321, P332+P313, and P362|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory.

Toxicity

Toxicity class：

practically nontoxic

α-Cedrene epoxide Use and Manufacturing

Manufacturing Info：

2H-2a,7-Methanoazuleno[5,6-b]oxirene, octahydro-3,6,6,7a-tetramethyl-, (1aS,2aR,3R,5aS,7R,7aR)-: ACTIVE|2H-2a,7-Methanoazuleno[5,6-b]oxirene, octahydro-3,6,6,7a-tetramethyl-: INACTIVE

Computed Properties

Molecular Weight:220.35
XLogP3:3.9
Hydrogen Bond Acceptor Count:1
Exact Mass:220.182715385
Monoisotopic Mass:220.182715385
Topological Polar Surface Area:12.5
Heavy Atom Count:16
Complexity:360
Undefined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes