AromaDb: A Database of Plant's Aroma Molecules

Geraniol Details

: IUPAC Name
(2E)-3,7-dimethylocta-2,6-dien-1-ol
:Chemical Class
Monoterpene
:CAS Registry Number
106-24-1
:Description

:Fragrance Type
rose

Physical and Chemical properties

PUBCHEM ID637566
Molecular Weight (mg/mol)154.249
Molecular FormulaC10H18O
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count4
IUPAC Name(2E)-3,7-dimethylocta-2,6-dien-1-ol
Canonical SMILESC/C(C)=CCC/C(C)=C/CO
PUBCHEM IUPAC INCHIKEYGLZPCOQZEFWAFX-JXMROGBWSA-N
Solubility Level3
Vapour Pressure-1.555

Absorption and Metabolism information

XLOGP3 AA2.9
CACTVS TPSA20.2
BBB Level1
Absorption Level0
EXT PPB#Prediction1
AlogP982.934
EXT CYP2D6#Prediction0

Toxicological Information

Mouse Female FDANon-Carcinogen
Mouse Male FDAMulti-Carcinogen
Rat Female FDASingle-Carcinogen
Rat Male FDAMulti-Carcinogen
Ames PredictionNon-Mutagen
Developmental / Reproductive ToxicityToxic
Rat Oral LD503.92477 g/kg_body_weight
Ocular IrritancyNone
Hepatotoxic#Prediction0
Effected Human GenesRDH16,CDKN1B,CDK2,FADS1,TYMS,ODC1,CDKN1A

Ecological Information

Aerobic Biodegradability PredictionDegradable

Hazard(s) Identification

Physical hazardsnot classified
Health hazards Moderate
Environmental hazardsnot classified
About Table Headings

Compound Biological Activity

Serial No.Cas No Gene SymbolOrganismInteraction Interaction ActionsPubMed Id
1 106-24-1
2 106-24-1
3 106-24-1
4 106-24-1
5 106-24-1
Serial No.Activity Name DetailsReferences (PubMed)Other details EPA (U.S)Clinical Trials (U.S. NIH)
1 106-24-1 Geraniol

Plant Variety and Essential oils

Serial No.Plant NameVariety NameEssential OilCompound Percentage
1 Bergot mint Kiran Mentha citrata Kiran essential oil
2 Clarysage CIM-Chandni Salvia sclarea CIM-Chandni essential oil
3 French basil, Indian basil, Sweet basil CIM-Saumya Ocimum basilicum CIM-Saumya essential oil
4 French basil, Indian basil, Sweet basil Kusumohak Ocimum basilicum Kusumohak essential oil
5 Geranium Pelargonium roseum essential oil
6 Geranium, Rose Scented Geranium CIM-BIO 171 Pelargonium graveolens CIM-BIO 171 essential oil
7 Geranium, Rose Scented Geranium CIM-Pawan Pelargonium graveolens CIM-Pawan essential oil
8 Geranium, Rose Scented Geranium Kelkar Pelargonium graveolens Kelkar essential oil
9 Rosemary CIM-Hariyali Rosmarinus officinali CIM-Hariyali essential oil
10 Lavendula angustifolia Sher-e-Kashmir Lavandula angustifolia sher-e-Kashmir essential oil
11 Lemongrass Cauvery Cymbopogon flexuosus Cauvery essential oil
12 Java Cittronella CIMAP-Bio-13 Cymbopogon winterianus CIMAP-Bio-13 essential oil
13 Lemon grass Cymbopogan citratus essential oil
14 Hook Cymbopogon microstachys essential oil
15 Cymbopogon Cymbopogon nardus essential oil
16 Curry tree Murraya koenigii essential oil
17 Starflower Borago officinalis essential oil
18 Java Cittronella Mandakni Cymbopogon winterianus Mandakni essential oil
19 Java Cittronella Manjari Cymbopogon winterianus Manjari essential oil
20 Java Cittronella Manjusha Cymbopogon winterianus Manjusha essential oil
21 Java Cittronella Medini Cymbopogon winterianus Medni essential oil
22 Rose, Damask Rose Noorjahan Rosa damascena Noorjahan essential oil
23 Rose, Damask Rose Ranisahiba Rose Ranisahiba essential oil
24 Sweet violet Viola odorata essential oil
25 Lemon myrtle, Lemon scented myrtle, Lemon scented ironwood Backhousia citriodora essential oil
26 Clove basil, African basil Ocimum gratissimum essential oil
27 Snowbell styrax officinalis essential oil
28 Balinese Cananga odorata essential oil
29 Common hop Humulus lupulus essential oil
30 Cummin Cuminum cyminum essential oil
31 Garden heliotrope Galium odoratum essential oil
32 Frangipani Plumeria obtusa essential oil
33 Frangipani Plumeria obtusa essential oil
34 Ginger Zingiber officinale essential oil
35 Aframomum stipulatum Aframomum stipulatum
36 Golden trumpet Allamanda cathartica essential oil
37 Lemon verbena Aloysia citrodora essential oil
38 Bottlebrushes Callistemon citrinus essential oil
39 Dictamnus albus Dictamnus albus essential oil
40 Dracocephalum moldavica NA
41 Elsholtzia blanda Elsholtzia blanda essential oil

Compound Image


2D Structure

Download




Download Sdf File Download PDB File Download MOL File
View Similar Structures
(External database - ChemAxon)