Miscellaneous

2-(1,4-Dihydroxycyclohexyl)acetic acid

PHY-NP-04020 · Natural product research catalog

Catalog number	PHY-NP-04020
CAS number	1310146-00-9
Molecular formula	C₈H₁₄O₄
Molecular weight	174.196 g/mol
Chemical class	Miscellaneous
Main reported source	Emilia sonchifolia
Purity / assay	Min. 98% Other purity specifications available on inquiry.

Chemical structure

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Pack	Price (USD)	Availability	Lead time
5 mg	Request quote	To be confirmed	Confirm in quotation
10 mg	Request quote	To be confirmed	Confirm in quotation
20 mg	Request quote	To be confirmed	Confirm in quotation
50 mg	Request quote	To be confirmed	Confirm in quotation
100 mg	Request quote	To be confirmed	Confirm in quotation

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Product information

2-(1,4-Dihydroxycyclohexyl)acetic acid is listed in the Miscellaneous section of the Phytide Bio research catalog. Standard pack sizes are 5, 10, 20, 50 and 100 mg.

For research use only. Not for human or veterinary use, diagnosis or treatment.

Names & identifiers

IUPAC name	2-(1,4-dihydroxycyclohexyl)acetic acid
SMILES	C1CC(CCC1O)(CC(=O)O)O
InChIKey	LHDVONJKFJRQTI-UHFFFAOYSA-N
PubChem CID	54033324

Computed properties

Exact mass (Da)	174.0892	Predicted LogP	0.1271
Predicted TPSA (Å²)	77.76	H-bond donors	3
H-bond acceptors	3	Rotatable bonds	2

Calculated values from the supplied dataset; not measured batch specifications.

View additional properties & classification

Ring count	1
Aromatic rings	0
Fraction Csp³	0.875
Synthetic accessibility score	2.6
QED score	0.556
Lipinski rule violations	0
Parent SMILES	O=C(O)CC1(O)CCC(O)CC1
Parent formula	C₈H₁₄O₄
Parent molecular weight	174.196
Specified stereocenters	0
Unspecified stereocenters	2

Reported natural occurrence

Main reported source	Emilia sonchifolia
Reported source families	Asteraceae; Oleaceae

Reported natural occurrence does not establish the manufacturing origin of the supplied material.

View occurrence records & references

LOTUS / Wikidata species	Emilia sonchifolia[1]; Forsythia suspensa[1]
All reported source families	Asteraceae[1]; Oleaceae[1]
LOTUS species records	2
LOTUS reference records	2
COCONUT organism records	0

Records are inherited from the supplied dataset and are not independently verified. Taxonomic names may include synonyms.

Documents & specifications

Certificate of analysis (COA)	Batch-specific COA available on request; no PDF published yet
Safety data sheet (SDS)	Not yet published
Storage / solubility	Product-specific conditions to be confirmed
Shipping	Confirmed with the quotation

Request applicable documentation and handling information before ordering or use.