489-40-7

Name (-)-ALPHA-GURJUNENE
CAS 489-40-7
EINECS(EC#) 207-695-1
Molecular Formula C15H24
MDL Number MFCD00043331
Molecular Weight 204.35
MOL File 489-40-7.mol

Chemical Properties

Boiling point  76-77 °C(Press: 3 Torr)
density  0.918 g/mL at 20 °C(lit.)
refractive index  n20/D 1.501
Fp  110℃
storage temp.  2-8°C
Odor at 100.00 %. wood balsam
Odor Type woody
Optical Rotation [α]20/D 213±5°, neat
BRN  1939514
Major Application food and beverages
Cosmetics Ingredients Functions PERFUMING
InChI InChI=1S/C15H24/c1-9-6-8-12-14(15(12,3)4)13-10(2)5-7-11(9)13/h9,11-12,14H,5-8H2,1-4H3/t9-,11-,12-,14-/m1/s1
InChIKey SPCXZDDGSGTVAW-XIDUGBJDSA-N
SMILES C1[C@@]2([H])C([C@]3([H])C(C)(C)[C@]3([H])CC[C@H]2C)=C(C)C1
LogP 6.386 (est)
EPA Substance Registry System 1H-Cycloprop[e]azulene, 1a,2,3,4,4a,5,6,7b-octahydro-1,1,4,7-tetramethyl-, (1aR,4R,4aR,7bS)- (489-40-7)

Safety Data

Symbol(GHS)  Health Hazard (GHS08)
GHS08
Signal word  Danger
Hazard statements  H304
Safety Statements 
WGK Germany  3
TSCA  TSCA listed
Storage Class 10 - Combustible liquids

Hazard Information

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