ChemicalBook--->CAS DataBase List--->1135-66-6

1135-66-6

1135-66-6 Structure

1135-66-6 Structure
IdentificationMore
[Name]

Isolongifolene
[CAS]

1135-66-6
[Synonyms]

(1R)-2,2,7,7-TETRAMETHYLTRICYCLO[6.2.1.0(1.6)]UNDEC-5-ENE
(-)-ISOLONGIFOLENE
ISOLONGIFOLENE
(-)-Isolongifoline
(2s)-1,3,4,5,6,7-hexahydro-1,1,5,5
(2s)-1,3,4,5,6,7-hexahydro-1,1,5,5-tetramethyl-2h-2,4a-methanonaphthalene
2H-2,4a-Methanonaphthalene, 1,3,4,5,6,7-hexahydro-1,1,5,5-tetramethyl-
2H-2,4a-Methanonaphthalene, 1,3,4,5,6,7-hexahydro-1,1,5,5-tetramethyl-, (2S,4aR)-(-)-
2H-2,4a-Methanonaphthalene, 1,3,4,5,6,7-hexahydro-1,1,5,5-tetramethyl-, (2S-cis)-
3,4,5,6,7-hexahydro-1,1,5,5-tetramethyl-4a-methanonaphthalen(2s)-2h-1
4a-Methanonaphthalene,1,3,4,5,6,7-hexahydro-1,1,5,5-tetramethyl-,(2S)-2H-2
Isolongipholene
C15 H24, 2H-2,4a-Methanonaphthalene, 1,3,4,5,6,7-hexahydro-1,1,5,5-tetramethyl-, (2S)-
ISOLONGIFOLENE(SG)
(2s)-2h-1,3,4,5,6,7-hexahydro-1,1,5,5-tetramethyl-4a-methanonaphthalen
1,3,4,5,6,7-Hexahydro-1,1,5,5-tetramethyl-2H-2,4a-methanonaphthalene
ISOLONGIFOLENE WITH GC
(2S,4aR)-1,2,3,4,4a,5,6,7-Octahydro-1,1,5,5-tetramethyl-2,4a-methanonaphthalene
(2S,4aR)-1,3,4,5,6,7-Hexahydro-1,1,5,5-tetramethyl-2H-2,4a-methanonaphthalene
(2S,4aR)-1,3,4,5,6,7-Hexahydro-1,1,5,5-tetramethyl-2H-2α,4aα-methanonaphthalene
[EINECS(EC#)]

214-494-2
[Molecular Formula]

C15H24
[MDL Number]

MFCD00042616
[Molecular Weight]

204.35
[MOL File]

1135-66-6.mol
Chemical PropertiesBack Directory
[Boiling point ]

255-256 °C
[density ]

0.930 g/mL at 20 °C(lit.)
[vapor pressure ]

5.49Pa at 25℃
[refractive index ]

n20/D 1.499
[Fp ]

49°C
[storage temp. ]

2-8°C
[solubility ]

DMSO: 10 mg/mL (48.94 mM)
[form ]

Liquid
[color ]

Colorless to light yellow
[Odor]

at 100.00 %. woody dusty amber incense
[Odor Type]

woody
[Optical Rotation]

[α]20/D 138±2°, c = 1% in ethanol
[Water Solubility ]

59.998μg/L at 25℃
[BRN ]

2207559
[Cosmetics Ingredients Functions]

PERFUMING
[InChI]

1S/C15H24/c1-13(2)8-5-6-12-14(3,4)11-7-9-15(12,13)10-11/h6,11H,5,7-10H2,1-4H3/t11-,15-/m0/s1
[InChIKey]

CQUAYTJDLQBXCQ-NHYWBVRUSA-N
[SMILES]

CC1(C)CCC=C2C(C)(C)[C@H]3CC[C@@]12C3
[LogP]

5.77 at 25℃
[CAS DataBase Reference]

1135-66-6(CAS DataBase Reference)
[NIST Chemistry Reference]

2H-2,4a-methanonaphthalene, 1,3,4,5,6,7-hexahydro-1,1,5,5-tetramethyl-, (2s)-(1135-66-6)
[EPA Substance Registry System]

1135-66-6(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Flame (GHS02)
GHS02
[Signal word ]

Warning
[Hazard statements ]

H225-H301+H311+H331-H370
[Precautionary statements ]

P210-P280-P301+P310+P330-P302+P352+P312-P304+P340+P311
[Risk Statements ]

R10:Flammable.
[RIDADR ]

UN 2319 3/PG 3
[WGK Germany ]

3
[TSCA ]

TSCA listed
[REACH Registrations]

Active
[HazardClass ]

3.2
[PackingGroup ]

III
[Storage Class]

3 - Flammable liquids
[Hazard Classifications]

Flam. Liq. 3
Hazard InformationBack Directory
[Uses]

(-)-Isolongifolene may be used in the preparation of (-)-isolongifolenone, a potent insect repellent.
[General Description]

(-)-Isolongifolene is a sesquiterpene that can be found in pine cone and Japanese cedar essential oils.
[Flammability and Explosibility]

Flammable
[storage]

Store at -20°C
[Purification Methods]

Reflux it over, and distil it from Na. [Zeiss & Arakawa J Am Chem Soc 76 1653 1954, IR: Reinaecker & Graafe Angew Chem, Int Ed Engl 97 348 1985, UV and NMR: Ranganathan et al. Tetrahedron 26 621 1970, Beilstein 5 IV 1191.]
Spectrum DetailBack Directory
[Spectrum Detail]

Isolongifolene(1135-66-6)1HNMR
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

1135-66-6(sigmaaldrich)
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