105-87-3
Product Name:
Geranyl acetate
Formula:
C12H20O2
Synonyms:
trans-3,7-Dimethyl-2,6-octadien-1-yl acetate;trans-3,7-Dimethyl-2,6-octadienyl acetate
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Geranyl acetate is a clear colorless liquid with an odor of lavender. (NTP, 1992) |
|---|---|
| Color/Form | Clear, colorless liquid |
| Odor | Odor of lavender |
| Taste | Taste threshold values: Taste characteristics at 20 ppm: Green, floral, fruity with a citrus nuance |
| Boiling Point | 468 °F at 760 mmHg (NTP, 1992) |
| Melting Point | < 25 °C |
| Flash Point | greater than 200 °F (NTP, 1992) |
| Solubility | less than 1 mg/mL at 68 °F (NTP, 1992) |
| Density | 0.907 at 77 °F (NTP, 1992) - Less dense than water; will float |
| Vapor Density | 6.8 (NTP, 1992) - Heavier than air; will sink (Relative to Air) |
| Vapor Pressure | 0.02 mmHg at 68 °F ; 1 mmHg at 164.3 °F (NTP, 1992) |
| LogP | log Kow = 4.04 |
| Optical Rotation | Specific optical rotation: -2 ro +2 degrees |
| Decomposition | When heated to decomposition it emits acrid smoke and irritating fumes. |
| Odor Threshold | Odor Threshold Low: 0.009 [mmHg] Odor Threshold High: 0.46 [mmHg] Odor threshold (detection) = 9 - 460 ppb |
| Refractive Index | INDEX OF REFRACTION: 1.4580-1.4640 AT 20 °C; 1.4570-1.4620 |
| Kovats Retention Index | 1360 1358 1358 1359 1360 1359 1365 1360 1355 1388 1363 1363 1358 1358 1363 1358 1359 1357 1356 1378 1359 1365 1358 1358 1358 1362 1359 1359 1359 1358 1358 1359 1359 1358 1358 1358 1358 1358 1358 1360 1359 1356 1366 1365 1366 1359 1362 1360 1360.3 1360.3 1361.5 1359 1357 1361 1361 1363 1356 1356 1360 1360 1370 1362 1364 1356 1368 1358 1362 1392 1359 1362 1362 1359 1358 1362 1362 1359 1364 1358 1360 1357 1362 1359.7 1365 1359 1363 1360 1363 1360 1360 1362 1362 1381 1388 1364 1359 1362 1358 1357 1357 1360 1360 1363 1360 1347 1409 1369 1370 1370 1380 1362 1350 1362 1354 1354 1358 1358 1362 1362 1370 1365 1358 1359 1365 1371 1361 1355 1363 1362 1363 1363 1362 1360 1340 1361 1370 1364 1362 1340 1340 1363 1364 1340 1363 1370 1345 1362 1364 1344 1369 1366 1359 1357 1364 1364 1387 1365 1356 1370 1365 1364 1360 1358 1361 1363 1370 1385 1359 1359 1363 1361.1 1361 1364 1361 1359 1361 1370 1363 1360 1360 1363 1361 1362 1363 1362 1361 1361 1359 1357 1363 1364 1359 1362 1357 1362 1364 1362 1364 1361 1367 1358 1361 |
| Other Experimental Properties | ASSAY: 90% MIN; 92% (85% TECHNICAL) |
| Chemical Classes | Other Classes -> Esters, Other |
SAFETY INFORMATION
| Signal word | Warning |
|---|---|
| Pictogram(s) |
 Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H315:Skin corrosion/irritation H317:Sensitisation, Skin H412:Hazardous to the aquatic environment, long-term hazard |
| Precautionary Statement Codes |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P264:Wash hands thoroughly after handling. P264:Wash skin thouroughly after handling. P272:Contaminated work clothing should not be allowed out of the workplace. P273:Avoid release to the environment. P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of soap and water. |
COMPUTED DESCRIPTORS
| Molecular Weight | 196.29 g/mol |
|---|---|
| XLogP3 | 3.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 6 |
| Exact Mass | 196.146329876 g/mol |
| Monoisotopic Mass | 196.146329876 g/mol |
| Topological Polar Surface Area | 26.3 Ų |
| Heavy Atom Count | 14 |
| Formal Charge | 0 |
| Complexity | 233 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Geranyl acetate is a clear colorless liquid with an odor of lavender. (NTP, 1992)