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(+)-AROMADENDRENE

(+)-AROMADENDRENE structure

CAS No:
489-39-4
Formula:
C15H24
Chemical Name:
(+)-AROMADENDRENE
Synonyms:
1H-Cycloprop[e]azulene, decahydro-1,1,7-trimethyl-4-methylene-, (1aR,4aR,7R,7aR,7bS)-(+)-;aromandendrene;(1R,2S,8R,11R)-7-METHYLENE-3,3,11-TRIMETHYL-TRICYCLO[6.3.0.0(2.4)]UNDECANE;(+)-AROMADENDRENE;AROMADENDRENE, (+);aromadendrene,aromadendrene,[1ar-(1aalpha,4aalpha,7alpha,7abeta,7balpha)]-decahydro-1,1,7-trimethyl-4-methylene-1H-cycloprop[e]azulene;AROMADENDRENE, (+)-(SG);(+)-AROMADENDRENE WITH GC
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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Description

(+)-Aromadendrene, a sesquiterpenoid, is the major constituent of the essential oil ofEucalypfus globulus.

(+)-AROMADENDRENE Basic Attributes

Molecular Weight：

204.35

Exact Mass：

204.35

BRN：

2554306

EC Number：

207-694-6

Color/Form：

Colourless to Pale Yellow

Characteristics

PSA：

XLogP3：

4.27090

Density：

0.912 g/mL at 20 °C (lit.)

Melting Point：

262°C

Boiling Point：

261-263 °C (lit.)

Flash Point：

90℃

Refractive Index：

n20/D1.497

Storage Conditions：

2-8°C

Critical Temperature & Pressure：

2-8°C

Safety Information

wgk germany：

Precautionary statement(s)：

P301+P310, P331, P405, P501

Hazard Statements：

H304

GHS Classification：

|Danger|H304 (100%): May be fatal if swallowed and enters airways [Danger Aspiration hazard]|P301+P310, P331, P405, and P501|Aggregated GHS information provided by 9 companies from 2 notifications to the ECHA C&L Inventory.

Drug Information

MeSH Entry Terms：

aromadendrene

(+)-AROMADENDRENE Use and Manufacturing

(+)-Aromadendrene may be used as a chiral starting material to synthesize other sesquiterenes such as (-)-apoaromadendrone, (-)-kessane, (+)-spathulenol, (+)-ledene and (-)-isoledene.

Computed Properties

Molecular Weight:204.35
XLogP3:4.7
Exact Mass:204.187800766
Monoisotopic Mass:204.187800766
Heavy Atom Count:15
Complexity:299
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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