acetic acid geranyl ester

Modify Date: 2024-01-02 06:31:17

acetic acid geranyl ester Structure
acetic acid geranyl ester structure
 Common Name acetic acid geranyl ester
CAS Number 105-87-3 Molecular Weight 196.286
Density 0.9±0.1 g/cm3 Boiling Point 247.5±0.0 °C at 760 mmHg
Molecular Formula C12H20O2 Melting Point < 25ºC
MSDS Chinese USA Flash Point 98.9±0.0 °C
Symbol GHS07
GHS07		 Signal Word Warning

 Use of acetic acid geranyl ester


Geranyl acetate, an acyclic monoterpene ester derived from geraniol, is widely used in the cosmetics industry due to its pleasant scent[1]. Geranyl acetate can induces cell apoptosis[2].

 Names

Name geranyl acetate
Synonym More Synonyms

 acetic acid geranyl ester Biological Activity

Description Geranyl acetate, an acyclic monoterpene ester derived from geraniol, is widely used in the cosmetics industry due to its pleasant scent[1]. Geranyl acetate can induces cell apoptosis[2].
Related Catalog
In Vitro Geranyl acetate exhibits significant anti-cancer activity against colo-205 cancer cell line with IC50 value of 30 μM[2]. Geranyl acetate induces apoptosis in colo-205 cells, this apoptosis is associated with upregulation of Bax and downregulation of Bcl-2 expressions[2].
References

[1]. Wu T, et al. Engineering Saccharomyces cerevisiae for the production of the valuable monoterpene ester geranyl acetate. Microb Cell Fact. 2018 Jun 5;17(1):85.

[2]. Qi F, et al. Geraniol and geranyl acetate induce potent anticancer effects in colon cancer Colo-205 cells by inducing apoptosis, DNA damage and cell cycle arrest. J BUON. 2018 Mar-Apr;23(2):346-352.

 Chemical & Physical Properties

Density 0.9±0.1 g/cm3
Boiling Point 247.5±0.0 °C at 760 mmHg
Melting Point < 25ºC
Molecular Formula C12H20O2
Molecular Weight 196.286
Flash Point 98.9±0.0 °C
Exact Mass 196.146332
PSA 26.30000
LogP 4.10
Vapour density 6.8 (vs air)
Vapour Pressure 0.0±0.5 mmHg at 25°C
Index of Refraction 1.458
Storage condition 2-8°C
Water Solubility <0.1 g/100 mL at 20 ºC

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
RG5920000
CHEMICAL NAME :
2,6-Octadien-1-ol, 3,7-dimethyl-, acetate, (E)-
CAS REGISTRY NUMBER :
105-87-3
BEILSTEIN REFERENCE NO. :
1722815
LAST UPDATED :
199701
DATA ITEMS CITED :
19
MOLECULAR FORMULA :
C12-H20-O2
MOLECULAR WEIGHT :
196.32
WISWESSER LINE NOTATION :
1Y&U3YU2OV1 -T

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Human - man
TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - guinea pig
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
6330 mg/kg
TOXIC EFFECTS :
Behavioral - somnolence (general depressed activity) Behavioral - coma
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
8 gm/kg
TOXIC EFFECTS :
Behavioral - somnolence (general depressed activity)
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
260 gm/kg/13W-I
TOXIC EFFECTS :
Related to Chronic Data - death
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
28 gm/kg/14D-I
TOXIC EFFECTS :
Related to Chronic Data - death
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
130 gm/kg/13W-I
TOXIC EFFECTS :
Liver - other changes Related to Chronic Data - death
TYPE OF TEST :
Unscheduled DNA synthesis

MUTATION DATA

TYPE OF TEST :
Sister chromatid exchange
TEST SYSTEM :
Rodent - hamster Ovary
DOSE/DURATION :
70 mg/L
REFERENCE :
EMMUEG Environmental and Molecular Mutagenesis. (Alan R. Liss, Inc., 41 E. 11th St., New York, NY 10003) V.10- 1987- Volume(issue)/page/year: 10(Suppl 10),1,1987 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOHS - National Occupational Hazard Survey (1974) NOHS Hazard Code - 83198 No. of Facilities: 53 (estimated) No. of Industries: 3 No. of Occupations: 35 No. of Employees: 7388 (estimated) NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - 83198 No. of Facilities: 3954 (estimated) No. of Industries: 19 No. of Occupations: 25 No. of Employees: 48026 (estimated) No. of Female Employees: 33271 (estimated)

 Safety Information

Symbol GHS07
GHS07
Signal Word Warning
Hazard Statements H315-H319-H335
Precautionary Statements P261-P305 + P351 + P338
Personal Protective Equipment Faceshields;full-face respirator (US);Gloves;Goggles;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
Hazard Codes Xi: Irritant;
Risk Phrases R36/37/38
Safety Phrases S26-S36-S24/25
RIDADR NONH for all modes of transport
WGK Germany 3
RTECS RG5920000

 Synthetic Route

 Articles11

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J. Insect Physiol. 78 , 33-46, (2015)

Phytophagous insects detect volatile compounds produced by host and non-host plants, using species-specific sets of olfactory receptor neurons (ORNs). To investigate the relationship between the range...
Bio-degradation of acetates of geraniol, nerol & citronellol by P. incognita: isolation & identification of metabolites.

Indian J. Biochem. Biophys. 20(3) , 136-40, (1983)
Mosquito odorant receptor for DEET and methyl jasmonate.

Proc. Natl. Acad. Sci. U. S. A. 111(46) , 16592-7, (2014)

Insect repellents are important prophylactic tools for travelers and populations living in endemic areas of malaria, dengue, encephalitis, and other vector-borne diseases. DEET (N,N-diethyl-3-methylbe...

 Synonyms

Geranylacetat
Geranyl acetate
(E)-3,7-Dimethyl-2,6-octadien-1-yl acetate
2,6-Octadien-1-ol, 3,7-dimethyl-, acetate, (2E)-
geranylacetate
Geranyl ethanonte
trans-3,7-Dimethyl-2,6-octadien-1-ol, acetate
Acetic acid, geranyl ester
MFCD00015037
trans-3,7-Dimethyl-2,6-octadien-1-ol acetate
FEMA 2509
EINECS 203-341-5
(2E)-3,7-Dimethyl-2,6-octadien-1-yl acetate
(2E)-3,7-Dimethylocta-2,6-dienyl acetate
trans-3,7-Dimethyl-2,6-octadienyl acetate
GERANIOL ACETATE
acetic acid geranyl ester
Beta-Geranyl Acetate
(2E)-3,7-Dimethylocta-2,6-dien-1-yl acetate
(E)-3,7-Dimethyl-2,6-octadien-1-ol acetate
2,6-dimethyl-2,6-octadien-8-yl acetate
2,6-Octadien-1-ol, 3,7-dimethyl-, acetate, trans-
3,7-dimethyl-2,6-octadienyl acetate
geranil acetate
femanumber2509.
geraniol acetate, trans-
Geranyl ethanoate
Acetic acid, geraniol ester
trans-3,7-dimethyl-2,6-octadien-1-yl acetate
1Y1&U3Y1&U2OV1 &&E Form
Meraneine
2,6-Octadien-1-ol, 3,7-dimethyl-, acetate, (E)-
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Chemsrc provides acetic acid geranyl ester(CAS#:105-87-3) MSDS, density, melting point, boiling point, structure, formula, molecular weight etc. Articles of acetic acid geranyl ester are included as well.>> amp version: acetic acid geranyl ester

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