Linalool Details

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Physical and Chemical properties

PUBCHEM ID	6549
CAS Registry Number	0.0
Aroma Threshold	0.0
Molecular Weight (g/mol)	154.249
Molecular Formula	C10H18O
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	4
IUPAC Name	3,7-dimethylocta-1,6-dien-3-ol
Canonical SMILES	C=CC(C)(O)CC/C=C(C)/C
PUBCHEM IUPAC INCHIKEY	CDOSHBSSFJOMGT-UHFFFAOYSA-N
Solubility Level	3
Vapour Pressure	-0.924

Absorption and Metabolism information

XLOGP3 AA	2.7
CACTVS TPSA	20.2
BBB Level	1
Absorption Level	0
EXT PPB#Prediction	1
AlogP98	2.735
EXT CYP2D6#Prediction	0

Toxicological Information

Mouse Female FDA	Non-Carcinogen
Mouse Male FDA	Multi-Carcinogen
Rat Female FDA	Single-Carcinogen
Rat Male FDA	Single-Carcinogen
Ames Prediction	Non-Mutagen
Developmental / Reproductive Toxicity	Toxic
Rat Oral LD50	1.37687 g/kg_body_weight
Ocular Irritancy	Severe
Hepatotoxic#Prediction	0
Effected Human Genes	HMGCR, TP53, SREBF2, DRD1, DRD2

Ecological Information

Aerobic Biodegradability Prediction

Degradable

Hazard(s) Identification

Physical hazards	not classified
Health hazards	Moderate
Environmental hazards	not classified

About Table Headings

Compound Biological Activity

Serial No.	Activity Name	Details	References (PubMed)	Other details EPA (U.S)	Clinical Trials (U.S. NIH)
1				78-70-6	Linalool

Plant Variety and Essential oils

Serial No.	Plant Name	Variety Name	Essential Oil	Compound Percentage
1	Clarysage	CIM-Chandni	Salvia sclarea CIM-Chandni essential oil
2	French basil, Indian basil, Sweet basil	CIM-Saumya	Ocimum basilicum CIM-Saumya essential oil
3	French basil, Indian basil, Sweet basil	Vikarsudha	Ocimum basilicum vikarsudha essential oil
4	French basil, Indian basil, Sweet basil	CIM-Sharada	Ocimum basilicum CIM-Sharada essential oil
5	French basil, Indian basil, Sweet basil	Kusumohak	Ocimum basilicum Kusumohak essential oil
6	Spearmint	Neera	Mentha spicata Neera essential oil
7	Menthol mint, Corn mint, Japanese mint	Damroo	Mentha arvensis Damroo essential oil
8	Menthol mint, Corn mint, Japanese mint	Himalaya	Mentha arvensis Himalaya essential oil
9	Menthol mint, Corn mint, Japanese mint	Kalka	Mentha arvensis Kalka essential oil
10	Menthol mint, Corn mint, Japanese mint	Kosi	Mentha arvensis Kosi essential oil
11	Menthol mint, Corn mint, Japanese mint	Kushal	Mentha arvensis Kushal essential oil
12	Menthol mint, Corn mint, Japanese mint	MAS-1	Mentha arvensis MAS-1 essential oil
13	Menthol mint, Corn mint, Japanese mint	Saksham	Mentha arvensis Saksham essential oil
14	Menthol mint, Corn mint, Japanese mint	Sambhav	Mentha arvensis Sambhav essential oil
15	Bergot mint	Kiran	Mentha citrata Kiran essential oil
16	Sweet flag, Vach, Bhoja	CIM-Balya	Acorus calamus CIM-Balya essential oil
17	Lemon Scented basil	CIM-Jyoti	Ocimum africanum CIM-Jyoti essential oil
18	Geranium		Pelargonium roseum essential oil
19	Geranium, Rose Scented Geranium	CIM-Pawan	Pelargonium graveolens CIM-Pawan essential oil
20	Geranium, Rose Scented Geranium	Kelkar	Pelargonium graveolens Kelkar essential oil
21	Rosemary	CIM-Hariyali	Rosmarinus officinali CIM-Hariyali
22	Lavandula angustifolia	Sher-e-Kashmir	Lavandula angustifolia sher-e-Kashmir
23	Dusky		Geranium phaeum essential oil
24	Lemon grass		Cymbopogan citratus
25	Hook		Cymbopogon microstachys
26	Citronella		Cymbopogon nardus
27	Curry tree		Murraya koenigii essential oil
28	Hornem		Ocimum ciliatum essential oil
29	Holy basil		Ocimum tenuiflorum essential oil
30	Starflower		Borago officinalis essential oil
31	Mulethi	Mishri	Glucyrrhiza glabra mulethi
32	Jasmin		Jasminum sambac essential oil
33	American wild mint		Mentha essential canadensis essential oil
34	Lemon beebalm, Lemon mint		Monarda citriodora essential oil
35	Geranium, Rose Scented Geranium	CIM-BIO 171	Pelargonium graveolens CIM-BIO 171 essential oil
36	Menthol mint, Corn mint, Japanese mint	CIM-Saryu	Mentha arvensis CIM-Saryu essential oil
37	Sweet wormwood, Quinghao	CIM-Arogya	Artemisia annua CIM-Arogya essential oil
38	Java Cittronella	Manjusha	Cymbopogon winterianus Manjusha
39	Lemongrass	Chirharit	Cymbopogon flexuosus Chirharit
40	Lemongrass	CIMAP-Suwarna	Cymbopogon flexuosus CIMAP-Suwarna
41	Sweet wormwood, Quinghao	Jeevanraksha	Artemisia annua Jeevanraksha essential oil
42	Lemongrass	Nima	Cymbopogon flexuosus Nima
43	Lemongrass	Krishna	Cymbopogon flexuosus krishna
44	Lemongrass	Praman	Cymbopogon flexuosus praman
45	Lemongrass	T-1	Cymbopogon flexuosus T-1
46	Java Cittronella	Medini	Cymbopogon winterianus Medni
47	Rose, Damask Rose	Noorjahan	Rosa damascena Noorjahan essential oil
48	Rose, Damask Rose	Ranisahiba	Rose Ranisahiba essential oil
49	Tegetes	Vanphool	Tagetes minuta Vanphool essential oil
50	Languas galanga		Alpinia galanga
51	Kuth		Saussurea lappa
52	Periwinkle, Sadabahar, Sadafuli	Dhawal	Catharanthus roseus dhawal essential oil
53	Sweet violet		Viola odorata essential oil
54	Myrtle		Myrtus communis essential oil
55	Clove basil, African basil		Ocimum gratissimum essential oil
56	Roth		Limnophila rugosa essential oil
57	Lemon balm		Melissa officinalis essential oil
58	Horse Mint		Mentha longifolia essential oil
59	Broadleaved lavender, spike lavender or Portuguese lavender		Lavandula latifolia essential oil
60	Clove nutmeg		Ravensara aromatica essential oil
61	Snowbell		styrax officinalis essential oil
62	Bay laurel, Sweet bay, Bay tree		Laurus nobilis essential oil
63	Cananga tree or Ylang-ylang		Cananga odorata essential oil
64	Common hop		Humulus lupulus essential oil
65	Cummin		Cuminum cyminum essential oil
66	Common yarrow		Achillea millefolium essential oil
67	Mexican pepperleaf		Piper auritum essential oil
68	Mexican pepperleaf		Piper auritum essential oil
69	Henna		Lawsonia inermis essential oil
70	Frangipani		Plumeria obtusa essential oil
71	Frangipani		Plumeria obtusa essential oil
72	Crimson beebalm, Scarlet beebalm		Crimson beebalm essential oil
73	Bulgarian fir		Abies borisii-regis essential oil
74	Abies cephalonica		Abies cephalonica essential oil
75	silver fir		Abies alba essential oil
76	Shampoo ginger. Bitter ginger		Zingiber zerumbet essential oil
77	Ginger		Zingiber officinale essential oil
78	sweet yarrow		Achillea ageratum essential oil
79	Goatweed		Ageratum conyzoides essential oil
80	Golden trumpet		Allamanda cathartica essential oil
81	Lemon verbena		Aloysia citrodora essential oil
82	Amyris elimifera		Amyris elimifera essential oil
83	Dill		Anethum graveolens essential oil
84	Jamun		Syzygium cordatum essential oil
85	Bushkiller		Cayratia japonica essential oil
86	Star Thistle Honey		Centaurea calcitrapa essential oil
87	Star Thistle Honey		Centaurea calcitrapa essential oil
88	Chaerophyllum villosum		Chaerophyllum villosum essential oil
89	Chaerophyllum villosum		Chaerophyllum villosum essential oil
90	Coriandrum Sativum		Coriandrum sativum essential oil
91	Coriandrum Sativum		Coriandrum sativum essential oil
92	Fireweed		Crassocephalum crepidioides essential oil
93	Fireweed		Crassocephalum crepidioides essential oil
94	Narrow-leaved turmeric		Curcuma angustifolia essential oil
95	Wild carrot		Daucus carota ssp. carota essential oil
96	Dracocephalum moldavica		NA
97	Elsholtzia blanda		Elsholtzia blanda essential oil
98	Satureja hortensis		Satureja hortensis essential oil
99	White horehound		Marrubium vulgare essential oil
100	Hibiscus surattensis		Hibiscus surattensis essential oil
101	Southern blue-gum		Eucalyptus globulus essential oil
102	Black Sage		Cordia verbenacea essential oil
103	West-Indian Woodnettle		Laportea aestuans essential oil
104	Xanthium strumarium		Xanthium strumarium essential oil
105	Hairless catmint		Nepeta nuda essential oil
106	Nepeta cadmea		Nepeta cadmea essential oil
107	Thymus schimperi		Thymus schimperi essential oil
108	Semenovia frigida		Semenovia frigida
109	turnip-rooted chervil		Chaerophyllum bulbosum essential oil
110	Geranium, Rose Scented Geranium	CIM-Sangam	Pelargonium graveolens CIM-Sangam