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Propanoic acid, 2-hydroxy-, 1,7,7-trimethylbicyclo[2.2.1]hept-2-yl ester

HCID 106971
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Basic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
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Basic information

CAS
67923-58-4
Standard SMILES
CC(O)C(=O)OC1CC2CCC1(C)C2(C)C
InChIKey
PKKVIPFBICXMFP-UHFFFAOYSA-N
Molecular formula
C13H22O3
Average molar mass
226.316 g/mol
Monoisotopic mass
226.15689456

Names & identifiers

Preferred name
Propanoic acid, 2-hydroxy-, 1,7,7-trimethylbicyclo[2.2.1]hept-2-yl ester
IUPAC
1,7,7-Trimethylbicyclo[2.2.1]heptan-2-yl 2-hydroxypropanoate
English name
1,7,7-trimethylbicyclo[2.2.1]hept-2-yl lactate
Molecular formula
C13H22O3
Molecular weight
226.31

Names & synonyms

Borneol lactateEinecs 267-774-11,7,7-trimethylbicyclo[2.2.1]hept-2-yl lactate1,7,7-Trimethylbicyclo(2,2,1)heptan-2-ol, 2-hydroxypropanoate2-Hydroxypropanoic acid 1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl esterPropanoic acid, 2-hydroxy-, 1,7,7-trimethylbicyclo(2.2.1)hept-2-yl esterPropanoic acid, 2-hydroxy-, 1,7,7-trimethylbicyclo(2.2.1)heptan-2-yl ester

Database identifiers

CAS
67923-58-4
PubChem CID
106971
DTXSID
DTXSID70867405
EC Number
267-774-1
Nikkaji
J317.222H

Properties

Physicochemical properties

Boiling point
290.8 · 290.8±13.0 °C(Predicted)
Density
1.08 · 1.08±0.1 g/cm3(Predicted)
pka
13.01 · 13.01±0.20(Predicted)
LogP
2.692 · 2.692 (est)
EPA Substance Registry System
Borneol lactate (67923-58-4)
TSCA
TSCA listed

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

tsca
TSCA listed

Related reactions

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Compound notes

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