(1R)-endo-( )-fenchol (Q64224715)

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chemical compound

• (1R,2R,4S)-1,3,3-trimethylbicyclo[2.2.1]heptan-2-ol
• ( )-fenchyl alcohol

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Language	Label	Description	Also known as
English	(1R)-endo-( )-fenchol	chemical compound	(1R,2R,4S)-1,3,3-trimethylbicyclo[2.2.1]heptan-2-ol ( )-fenchyl alcohol

Statements

instance of

type of chemical entity

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subclass of

fenchol

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chemical structure

(1R)-endo-( )-Fenchol.svg
240 × 275; 8 KB

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mass

154.135765196 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(-)-α-fenchyl alcohol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

beta-fenchol

1 reference

based on heuristic

inferred from InChI

(-)-β-fenchyl alcohol

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₀H₁₈O

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canonical SMILES

OC1C(C)(C)C2CCC1(C)C2

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isomeric SMILES

C[C@@]12CC[C@@H](C1)C([C@@H]2O)(C)C

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melting point

41.0 degree Celsius

1 reference

stated in

Jean-Claude Bradley Open Melting Point Dataset

found in taxon

Foeniculum vulgare

1 reference

stated in

Contribution for the Characterization of Portuguese Fennel Chemotypes

Cleonia lusitanica

1 reference

stated in

The Essential Oil ofCleonia lusitanica

Zanthoxylum armatum

2 references

stated in

Hydroxyalk-(4Z)-enoic Acids and Volatile Components from the Seeds of Zanthoxylum armatum

stated in

Chemical constituents from the seeds of Zanthoxylum alatum

Myrtus communis

2 references

stated in

The Chemical Composition of Spanish Myrtle Leaf Oils. Part I.

stated in

The Chemical Composition of Spanish Myrtle Oils. Part II

Helichrysum odoratissimum

1 reference

stated in

The Chemical Composition of the Essential Leaf Oil ofHelichrysum odoratissimumSweet from Zimbabwe

Eucalyptus botryoides

1 reference

stated in

Essential Oils of Twenty-sevenEucalyptusSpecies Grown in Morocco

Eucalyptus siderophloia

1 reference

stated in

Essential Oils of Twenty-sevenEucalyptusSpecies Grown in Morocco

Eucalyptus moluccana

1 reference

stated in

Essential Oils of Twenty-sevenEucalyptusSpecies Grown in Morocco

Eucalyptus exserta

1 reference

stated in

Essential Oils of Twenty-sevenEucalyptusSpecies Grown in Morocco

Eucalyptus paniculata

1 reference

stated in

Essential Oils of Twenty-sevenEucalyptusSpecies Grown in Morocco

Eucalyptus saligna

1 reference

stated in

Essential Oils of Twenty-sevenEucalyptusSpecies Grown in Morocco

Eucalyptus punctata

1 reference

stated in

Essential Oils of Twenty-sevenEucalyptusSpecies Grown in Morocco

Eucalyptus blakelyi

1 reference

stated in

Essential Oils of Twenty-sevenEucalyptusSpecies Grown in Morocco

Eucalyptus albens

1 reference

stated in

Essential Oils of Twenty-sevenEucalyptusSpecies Grown in Morocco

Uvaria narum

1 reference

stated in

The Root Bark Essential Oil of Uvaria narum Wall.

Aster scaber

1 reference

stated in

Volatile compounds isolated from edible Korean chamchwi (Aster scaber Thunb)

Alpinia breviligulata

1 reference

stated in

Constituents of the Rhizome and Root Oils ofAlpinia breviligulataGagnep. from Vietnam

Cryptomeria japonica

1 reference

stated in

Monoterpenoid and sesquiterpenoid constituents of the essential oil of sugi (Cryptomeria japonica D. Don.).

Elettaria cardamomum

1 reference

stated in

Fumigant toxicity and oviposition deterrency of the essential oil from cardamom, Elettaria cardamomum, against three stored–product insects

Cannabis sativa

1 reference

stated in

Constituents of Cannabis sativa L. XVII. A review of the natural constituents

Citrus ×iyo

1 reference

stated in

Composition of oxygenated compounds in peel oil from Citrus iyo and its variation during storage.

Liquidambar styraciflua

1 reference

stated in

Constituents of Essential Oil from Leaves of Liquidambar styraciflua L.1

Teucrium pseudoscorodonia

1 reference

stated in

The volatiles of six Teucrium species from the iberian peninsula and the balearic islands

Teucrium asiaticum

1 reference

stated in

The volatiles of six Teucrium species from the iberian peninsula and the balearic islands

Teucrium oxylepis

1 reference

stated in

The volatiles of six Teucrium species from the iberian peninsula and the balearic islands

Teucrium salviastrum

1 reference

stated in

The volatiles of six Teucrium species from the iberian peninsula and the balearic islands

Teucrium scorodonia

1 reference

stated in

The volatiles of six Teucrium species from the iberian peninsula and the balearic islands

Etlingera elatior

1 reference

stated in

Constituents of the Flower Oil ofAlpinia speciosaK. Schum. from Vietnam

Teucrium siculum

1 reference

stated in

The volatiles of six Teucrium species from the iberian peninsula and the balearic islands

Eucalyptus cladocalyx

1 reference

stated in

Essential Oils of Twenty-sevenEucalyptusSpecies Grown in Morocco

Alpinia zerumbet

1 reference

stated in

Constituents of the Flower Oil ofAlpinia speciosaK. Schum. from Vietnam

Identifiers

InChI

InChI=1S/C10H18O/c1-9(2)7-4-5-10(3,6-7)8(9)11/h7-8,11H,4-6H2,1-3H3/t7-,8-,10 /m0/s1

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InChIKey

IAIHUHQCLTYTSF-OYNCUSHFSA-N

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CAS Registry Number

2217-02-9

1 reference

InChIKey

IAIHUHQCLTYTSF-OYNCUSHFSA-N

stated in

CAS Common Chemistry

retrieved

9 April 2021

reference URL

https://commonchemistry.cas.org/detail?cas_rn=2217-02-9

ChemSpider ID

5365080

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PubChem CID

6997371

1 reference

matched by identifier from

InChIKey

InChIKey

IAIHUHQCLTYTSF-OYNCUSHFSA-N

ChEMBL ID

CHEMBL3188732

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UniChem compound ID

1838709

1 reference

stated in

UniChem

DSSTox substance ID

DTXSID6044307

2 references

stated in

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

matched by identifier from

InChIKey

InChIKey

IAIHUHQCLTYTSF-OYNCUSHFSA-N

DSSTOX compound identifier

DTXCID4024307

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EC number

606-948-7

1 reference

stated in

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.133.592

retrieved

29 July 2019

title

(1R,2R,4S)- 1,3,3-trimethylbicyclo(2.2.1)heptan-2-ol (English)

quotation

CAS no.: 2217-02-9 (English)

ECHA Substance Infocard ID

100.133.592

1 reference

stated in

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.133.592

retrieved

29 July 2019

title

(1R,2R,4S)- 1,3,3-trimethylbicyclo(2.2.1)heptan-2-ol (English)

quotation

CAS no.: 2217-02-9 (English)

Cannabis Database ID

000607

1 reference

stated in

Cannabis Database

KNApSAcK ID

C00058842

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

InChIKey

IAIHUHQCLTYTSF-OYNCUSHFSA-N

UNII

OW0KEP592N

1 reference

matched by identifier from

InChIKey

InChIKey

IAIHUHQCLTYTSF-OYNCUSHFSA-N

32Y92U27DU

1 reference

matched by identifier from

InChIKey

InChIKey

IAIHUHQCLTYTSF-OYNCUSHFSA-N

Probes And Drugs ID

PD077207

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Wiktionary(0 entries)

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