ChemicalBook--->CAS DataBase List--->7785-33-3

7785-33-3

7785-33-3 Structure

7785-33-3 Structure
IdentificationBack Directory
[Name]

Geranyl tiglate
[CAS]

7785-33-3
[Synonyms]

FEMA 4044
Geranyltiglat
Gernyl tiglate
GERANYL TIGLATE
GERANYLTIGLINAT
α-Geraniol tiglate
Tiglicacidgeranylester
tiglicacid,geraniolester
Tiglic acid, geraniol ester
GERANYL TRANS-2-METHYL-2-BUTENOATE
3,7-DIMETHYL-2,6-OCTADIEN-L-YL-TIGLATE
3,7-Dimethyl-2,6-Octadien-1-yl tiglate
(E)-3,7-Dimethyl-2,6-octadienyl-2-methylcrotonat
cis-alpha,beta-dimethylacrylicacid,geraniolester
(E)-3,7-dimethyl-2,6-octadienyl 2-methylcrotonate
cis-alpha,beta-Dimethyl acrylic acid, geraniol ester
3,7-dimethyl-,2-methyl-2-butenoate,(e,e,e)-6-octadien-1-ol
(2E)-3,7-Dimethyl-2,6-octadienyl (2E)-2-methyl-2-butenoate
(E)-(E)-3,7-diMethylocta-2,6-dien-1-yl 2-Methylbut-2-enoate
2-methyl-,3,7-dimethyl-2,6-octadienylester,(e,e)-2-butenoicaci
2-methyl-,3,7-dimethyl-2,6-octadienylester,(E,E)-2-Butenoicacid
2,6-Octadien-1-ol, 3,7-dimethyl-, 2-methyl-2-butenoate, (E,E)--
2-methyl-,3,7-dimethyl-2,6-octadienylester,(e,e,e)-2-butenoicaci
(E,E)-2-Methyl-2-butenoic acid 3,7-dimethyl-2,6-octadienyl ester
(E)-2-Methyl-2-butenoic acid (7-methyl-3-methylene-6-octenyl) ester
trans-3,7-dimethyl-2,6-octadien-1-ylcis-alpha,beta-dimethylacrylate
(E)-2-Methyl-2-butenoic acid [(E)-3,7-dimethyl-2,7-octadienyl] ester
2-Butenoic acid, 2-methyl-, 3,7-dimethyl-2,6-octadienyl ester, (E,E)-
trans-3,7-Dimethyl-2,6-octadien-1-yl cis-alpha,beta-dimethyl acrylate
2-Butenoic acid, 2-methyl-, (2E)-3,7-dimethyl-2,6-octadienyl ester, (2E)-
3,7-Dimethyl-2,6-Octadien-1-yl tiglate, Geranyl trans-2-methyl-2-butenoate
[EINECS(EC#)]

232-078-9
[Molecular Formula]

C15H24O2
[MDL Number]

MFCD00016622
[MOL File]

7785-33-3.mol
[Molecular Weight]

236.35
Chemical PropertiesBack Directory
[Boiling point ]

149-151 °C/7 mmHg(lit.)
[density ]

0.923 g/mL at 25 °C(lit.)
[FEMA ]

4044 | GERANYL TIGLATE
[refractive index ]

n20/D 1.480-1.484(lit.)
[Fp ]

113 °C
[storage temp. ]

Store at room temperature
[form ]

clear liquid
[color ]

A colourless oily liquid with a geranium, fruit-like odour
[Odor]

at 10.00 % in dipropylene glycol. geranium fruity sweet herbal
[Odor Type]

floral
[JECFA Number]

1822
[Major Application]

flavors and fragrances
[Cosmetics Ingredients Functions]

PERFUMING
[InChI]

1S/C15H24O2/c1-6-14(5)15(16)17-11-10-13(4)9-7-8-12(2)3/h6,8,10H,7,9,11H2,1-5H3/b13-10+,14-6+
[InChIKey]

OGHBUHJLMHQMHS-KRDNBFTESA-N
[SMILES]

[H]\C(C)=C(\C)C(=O)OC\C=C(/C)CC\C=C(\C)C
[LogP]

5.73
[CAS DataBase Reference]

7785-33-3
[NIST Chemistry Reference]

Geranyl tiglate(7785-33-3)
[EPA Substance Registry System]

2-Butenoic acid, 2-methyl-, (2E)-3,7-dimethyl-2,6-octadienyl ester, (2E)-(7785-33-3)
Safety DataBack Directory
[WGK Germany ]

WGK 2
[RTECS ]

RG5927900
[TSCA ]

TSCA listed
[HS Code ]

2916.19.5000
[Storage Class]

10 - Combustible liquids
[Toxicity]

Both the acute oral LD50 value in rats and the acute dermal LD50 value in rabbits exceeded 5 g/kg (Shelanski, 1972).
Hazard InformationBack Directory
[Chemical Properties]

Geranyl tiglate has a pleasant, herbaceous, geranium and fruity odor.
[Occurrence]

Reported found in kumquat and geranium oil
[Uses]

flavors and fragrances
[Definition]

ChEBI:Geranyl tiglate is a carboxylic ester.
[Preparation]

Prepared in a patented process by reaction of sodium hydroxide, geraniol and methyl tiglate.
[Aroma threshold values]

Aroma characteristics at 1.0%: fresh sweet green melon with a slight harsh herbaceous melonal nuance with a powdery rosy nuance.
[Taste threshold values]

Taste characteristics at 5 to 10 ppm: green, estry melon, berry seedy with a foral and slightly fatty nuance.
Spectrum DetailBack Directory
[Spectrum Detail]

Geranyl tiglate(7785-33-3)1HNMR
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