2-[1-(carboxymethyl)-3-methyl-cyclohexyl]acetic acid

Modify Date: 2026-08-03 08:26:38

2-[1-(carboxymethyl)-3-methyl-cyclohexyl]acetic acid Structure
2-[1-(carboxymethyl)-3-methyl-cyclohexyl]acetic acid structure
Common Name 2-[1-(carboxymethyl)-3-methyl-cyclohexyl]acetic acid
CAS Number 5345-12-0 Molecular Weight 214.25800
Density 1.132g/cm3 Boiling Point 404.4ºC at 760 mmHg
Molecular Formula C11H18O4 Melting Point N/A
MSDS N/A Flash Point 212.5ºC

 Names

Name 2-[1-(carboxymethyl)-3-methylcyclohexyl]acetic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.132g/cm3
Boiling Point 404.4ºC at 760 mmHg
Molecular Formula C11H18O4
Molecular Weight 214.25800
Flash Point 212.5ºC
Exact Mass 214.12100
PSA 74.60000
LogP 2.13230
Index of Refraction 1.483
InChIKey HJPDHTDUPWGUHP-UHFFFAOYSA-N
SMILES CC1CCCC(CC(=O)O)(CC(=O)O)C1

 Safety Information

HS Code 2917209090

 Synthetic Route

~%

2-[1-(carboxymethyl)-3-methyl-cyclohexyl]acetic acid Structure

2-[1-(carboxyme...

CAS#:5345-12-0

Learn More
Literature: Mathur,K.C.; Saharia,G.S. Indian Journal of Chemistry, 1965 , vol. 3, p. 17 - 19

~%

2-[1-(carboxymethyl)-3-methyl-cyclohexyl]acetic acid Structure

2-[1-(carboxyme...

CAS#:5345-12-0

Learn More
Literature: Thorpe; Wood Journal of the Chemical Society, 1913 , vol. 103, p. 1575 Journal of the Chemical Society, 1923 , vol. 123, p. 63

~%

2-[1-(carboxymethyl)-3-methyl-cyclohexyl]acetic acid Structure

2-[1-(carboxyme...

CAS#:5345-12-0

Learn More
Literature: Thorpe; Wood Journal of the Chemical Society, 1913 , vol. 103, p. 1575 Journal of the Chemical Society, 1923 , vol. 123, p. 63

~%

2-[1-(carboxymethyl)-3-methyl-cyclohexyl]acetic acid Structure

2-[1-(carboxyme...

CAS#:5345-12-0

Learn More
Literature: Thorpe; Wood Journal of the Chemical Society, 1913 , vol. 103, p. 1575 Journal of the Chemical Society, 1923 , vol. 123, p. 63

~%

2-[1-(carboxymethyl)-3-methyl-cyclohexyl]acetic acid Structure

2-[1-(carboxyme...

CAS#:5345-12-0

Learn More
Literature: Thorpe; Wood Journal of the Chemical Society, 1913 , vol. 103, p. 1575 Journal of the Chemical Society, 1923 , vol. 123, p. 63

 Customs

HS Code 2917209090
Summary 2917209090 other cyclanic, cyclenic or cyclotherpenic polycarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives。supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward)。VAT:17.0%。tax rebate rate:9.0%。MFN tariff:6.5%。general tariff:30.0%

 Bioassay

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Name: Primary cell-based high-throughput screening assay for identification of compounds th...
Source: Johns Hopkins Ion Channel Center
Target: regulator of G-protein signaling 4 isoform 2 [Homo sapiens]
External Id: JHICC_RGS_Act_HTS
Name: Luminescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id: OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
Name: QFRET-based biochemical primary high throughput screening assay to identify exosite i...
Source: The Scripps Research Institute Molecular Screening Center
Target: disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id: ADAM17_INH_QFRET_1536_1X%INH PRUN
Name: Fluorescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_AG_FLUO8_1536_1X%ACT PRUN
Name: uHTS identification of small molecule activators of the adaptive arm of the Unfolded ...
Source: Burnham Center for Chemical Genomics
Target: N/A
External Id: BCCG-A405-UPR-XBP1-PrimaryAgonist-Assay
Name: Antibacterial activity against Klebsiella pneumoniae MDR ATCC 70063 (CO-ADD:GN_003); ...
Source: ChEMBL
Target: Klebsiella pneumoniae
External Id: CHEMBL4296186
Name: High throughput fluorescence intensity-based biochemical assay to screen for small mo...
Source: University of Pittsburgh Molecular Library Screening Center
Target: furin (paired basic amino acid cleaving enzyme), isoform CRA_a [Homo sapiens]
External Id: MH080376 Biochemical HTS for Inhibitors of the Proprotein Convertase Furin.
Name: Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
Source: Broad Institute
Target: FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id: 2147-01_Inhibitor_SinglePoint_HTS_Activity
Name: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect...
Source: Broad Institute
Target: N/A
External Id: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity
Name: Identifying Sarm1 TIR NADase inhibitors through high throughput HPLC assay
Source: 24386
Target: N/A
External Id: Sarm1 TIR NADase inhibitors
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 Synonyms

(3-methyl-cyclohexylidene)-di-acetic acid
(3-Methyl-cyclohexyliden)-di-essigsaeure
1,1-Dicarboxymethyl-3-methyl-cyclohexan
3-Methyl-cyclohexan-diessigsaeure-(1.1)
2,2'-(3-methylcyclohexane-1,1-diyl)diacetic acid
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