Neoisomenthol

PubChem CID: 19244

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Compound Synonyms	Neoisomenthol, 20752-34-5, (+)-neoisomenthol, iso-neomenthol, (+/-)-Neoisomenthol, (R,R,R)-Menthol, (1R,2R,5R)-2-isopropyl-5-methylcyclohexanol, d-neo-Menthol, cis-1,3,cis-1,4-menthol, Neoisomenthol, (+)-, 491-02-1, cyclohexanol, 5-methyl-2-(1-methylethyl)-, (1R,2R,5R)-, DL-ISOMENTHOL, 90E7IB31QH, (1R,2R,5R)-5-methyl-2-propan-2-ylcyclohexan-1-ol, rel-(1R,2R,5R)-5-methyl-2-(propan-2-yl)cyclohexan-1-ol, CHEBI:18451, (1alpha,2alpha,5alpha)-5-methyl-2-(1-methylethyl)cyclohexanol, DTXSID80895815, (1R,2R,5R)-Isomenthol, p-Menthan-3-ol, MENTHOL, (1R,3R,4R)-(+)-, Cyclohexanol, 5-methyl-2-(1-methylethyl)-, (1theta-(1alpha,2alpha,5alpha))-, (1R,2R,5R)-rel-2-Isopropyl-5-methylcyclohexanol, FEMA No. 2666, Cyclohexanol, 5-methyl-2-(1-methylethyl)-, (1.alpha.,2.alpha.,5.alpha.)-, (1R,2R,5R)-5-methyl-2-(propan-2-yl)cyclohexan-1-ol, CYCLOHEXANOL, 5-METHYL-2-(1-METHYLETHYL)-, (1R-(1.ALPHA.,2.ALPHA.,5.ALPHA.))-, Cyclohexanol, 5-methyl-2-(1-methylethyl)-, [1R-(1.alpha.,2.alpha.,5.alpha.)]-, 490-99-3, (1R,?2R,?5R)?-?2-?Isopropyl-?5-?methylcyclohexanol, UNII-90E7IB31QH, Isoneomenthol, NEOISOMENTHOL, (+/-)-, menthol (iso-), (1R,3R,4R)-(+)-Menthol, (1R,2R,5R)-5-Methyl-2-(1-methylethyl)cyclohexanol, (+)-Neoisomenthol, (R,R,R)-Menthol, , 89-78-1, MFCD09834087, (1R)-(+)-neoisomenthol, (1R,3R,4R)-form, SCHEMBL1703569, NOOLISFMXDJSKH-OPRDCNLKSA-, DTXCID701325321, LMPR0102090057, NCGC00142588-01, CS-0239800, NS00114068, EN300-219194, (1R,2R,5R)-2-Isopropyl-5-methylcyclohexan-1-ol, Q27109029, 2-Isopropyl-5-methylcyclohexanol, (1.alpha.,2.alpha.,5.alpha.)-, CYCLOHEXANOL, 5-METHYL-2-(1-METHYLETHYL)-, (1R-(1ALPHA,2ALPHA,5ALPHA))-, 207-724-8, InChI=1/C10H20O/c1-7(2)9-5-4-8(3)6-10(9)11/h7-11H,4-6H2,1-3H3/t8-,9-,10-/m1/s1
Topological Polar Surface Area	20.2
Hydrogen Bond Donor Count	1.0
Heavy Atom Count	11.0
Description	Found in many essential oils [CCD]
Isotope Atom Count	0.0
Molecular Complexity	120.0
Database Name	cmaup_ingredients;fooddb_chem_all;hmdb_chem_all;npass_chem_all;pubchem
Defined Atom Stereocenter Count	3.0
Iupac Name	(1R,2R,5R)-5-methyl-2-propan-2-ylcyclohexan-1-ol
Prediction Hob	1.0
Class	Prenol lipids
Xlogp	3.0
Superclass	Lipids and lipid-like molecules
Subclass	Monoterpenoids
Molecular Formula	C10H20O
Prediction Swissadme	0.0
Inchi Key	NOOLISFMXDJSKH-OPRDCNLKSA-N
Fcsp3	1.0
Logs	-2.827
Rotatable Bond Count	1.0
State	Liquid
Logd	3.504
Synonyms	(+)-Neoisomenthol, (1a,2a,5a)-5-Methyl-2-(1-methylethyl)cyclohexanol, (1alpha,2alpha,5alpha)-5-Methyl-2-(1-methylethyl)cyclohexanol, (1R,3R,4R)-Form, (1α,2α,5α)-5-methyl-2-(1-methylethyl)cyclohexanol, Iso-neomenthol, p-Menthan-3-ol, (1R,3R,4R)-form, cis-1,3,cis-1,4-Menthol, (1Α,2α,5α)-5-methyl-2-(1-methylethyl)cyclohexanol, P-Menthan-3-ol, Isomenthol
Substituent Name	Menthane monoterpenoid, Monocyclic monoterpenoid, Cyclohexanol, Cyclic alcohol, Secondary alcohol, Hydrocarbon derivative, Organooxygen compound, Alcohol, Aliphatic homomonocyclic compound
Compound Name	Neoisomenthol
Kingdom	Organic compounds
Prediction Hob Swissadme	0.0
Exact Mass	156.151
Formal Charge	0.0
Monoisotopic Mass	156.151
Hydrogen Bond Acceptor Count	1.0
Molecular Weight	156.26
Covalent Unit Count	1.0
Total Atom Stereocenter Count	3.0
Total Bond Stereocenter Count	0.0
Molecular Framework	Aliphatic homomonocyclic compounds
Esol	-2.8848678000000003
Inchi	InChI=1S/C10H20O/c1-7(2)9-5-4-8(3)6-10(9)11/h7-11H,4-6H2,1-3H3/t8-,9-,10-/m1/s1
Smiles	C[C@@H]1CC[C@@H]([C@@H](C1)O)C(C)C
Nring	1.0
Defined Bond Stereocenter Count	0.0
Taxonomy Direct Parent	Menthane monoterpenoids

1. Outgoing r'ship FOUND_IN to/from Abies Canadensis (Plant) Rel Props:Reference:
2. Outgoing r'ship FOUND_IN to/from Anagallis Arvensis (Plant) Rel Props:Reference:
3. Outgoing r'ship FOUND_IN to/from Asarum Canadensis (Plant) Rel Props:Reference:
4. Outgoing r'ship FOUND_IN to/from Buglossoides Arvensis (Plant) Rel Props:Reference:
5. Outgoing r'ship FOUND_IN to/from Calendula Arvensis (Plant) Rel Props:Reference:
6. Outgoing r'ship FOUND_IN to/from Collinsonia Canadensis (Plant) Rel Props:Reference:
7. Outgoing r'ship FOUND_IN to/from Convolvulus Arvensis (Plant) Rel Props:Reference:
8. Outgoing r'ship FOUND_IN to/from Conyza Canadensis (Plant) Rel Props:Reference:
9. Outgoing r'ship FOUND_IN to/from Dicentra Canadensis (Plant) Rel Props:Reference:
10. Outgoing r'ship FOUND_IN to/from Erigeron Canadensis (Plant) Rel Props:Reference:
11. Outgoing r'ship FOUND_IN to/from Filago Arvensis (Plant) Rel Props:Reference:
12. Outgoing r'ship FOUND_IN to/from Goniothalamus Arvensis (Plant) Rel Props:Reference:
13. Outgoing r'ship FOUND_IN to/from Hydrastis Canadensis (Plant) Rel Props:Reference:
14. Outgoing r'ship FOUND_IN to/from Lactuca Canadensis (Plant) Rel Props:Reference:
15. Outgoing r'ship FOUND_IN to/from Mentha Aquatica (Plant) Rel Props:Reference:
16. Outgoing r'ship FOUND_IN to/from Mentha Arvensis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
17. Outgoing r'ship FOUND_IN to/from Mentha Canadensis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
18. Outgoing r'ship FOUND_IN to/from Mentha Cardiaca (Plant) Rel Props:Reference:
19. Outgoing r'ship FOUND_IN to/from Mentha Cordifolia (Plant) Rel Props:Reference:
20. Outgoing r'ship FOUND_IN to/from Mentha Diemenica (Plant) Rel Props:Reference:
21. Outgoing r'ship FOUND_IN to/from Mentha Gattefossei (Plant) Rel Props:Reference:
22. Outgoing r'ship FOUND_IN to/from Mentha Grandiflora (Plant) Rel Props:Reference:
23. Outgoing r'ship FOUND_IN to/from Mentha Incana (Plant) Rel Props:Reference:
24. Outgoing r'ship FOUND_IN to/from Mentha Japonica (Plant) Rel Props:Reference:
25. Outgoing r'ship FOUND_IN to/from Mentha Longifolia (Plant) Rel Props:Reference:
26. Outgoing r'ship FOUND_IN to/from Mentha Piperita (Plant) Rel Props:Reference:
27. Outgoing r'ship FOUND_IN to/from Mentha Pulegiformis (Plant) Rel Props:Reference:
28. Outgoing r'ship FOUND_IN to/from Mentha Pulegium (Plant) Rel Props:Reference:
29. Outgoing r'ship FOUND_IN to/from Mentha Requienii (Plant) Rel Props:Reference:
30. Outgoing r'ship FOUND_IN to/from Mentha Rotundifolia (Plant) Rel Props:Reference:
31. Outgoing r'ship FOUND_IN to/from Mentha Spicata (Plant) Rel Props:Reference:
32. Outgoing r'ship FOUND_IN to/from Mentha Suaveolens (Plant) Rel Props:Reference:
33. Outgoing r'ship FOUND_IN to/from Mentha Sylvestris (Plant) Rel Props:Reference:
34. Outgoing r'ship FOUND_IN to/from Mentha Timija (Plant) Rel Props:Reference:
35. Outgoing r'ship FOUND_IN to/from Mentha X (Plant) Rel Props:Reference:
36. Outgoing r'ship FOUND_IN to/from Nigella Arvensis (Plant) Rel Props:Reference:
37. Outgoing r'ship FOUND_IN to/from Polygala Arvensis (Plant) Rel Props:Reference:
38. Outgoing r'ship FOUND_IN to/from Ranunculus Arvensis (Plant) Rel Props:Reference:
39. Outgoing r'ship FOUND_IN to/from Sambucus Canadensis (Plant) Rel Props:Reference:
40. Outgoing r'ship FOUND_IN to/from Sanguinaria Canadensis (Plant) Rel Props:Reference:
41. Outgoing r'ship FOUND_IN to/from Sinapis Arvensis (Plant) Rel Props:Reference:
42. Outgoing r'ship FOUND_IN to/from Solidago Canadensis (Plant) Rel Props:Reference:
43. Outgoing r'ship FOUND_IN to/from Sonchus Arvensis (Plant) Rel Props:Reference:
44. Outgoing r'ship FOUND_IN to/from Spergula Arvensis (Plant) Rel Props:Reference:
45. Outgoing r'ship FOUND_IN to/from Taxus Canadensis (Plant) Rel Props:Reference:
46. Outgoing r'ship FOUND_IN to/from Torilis Arvensis (Plant) Rel Props:Reference:
47. Outgoing r'ship FOUND_IN to/from Veronica Arvensis (Plant) Rel Props:Reference:

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Neoisomenthol

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Phytochemical Properties

Associated Connections 47

Plant Connections 47