Benzeneheptanoic acid, g,z-dioxo

Modify Date: 2025-08-26 08:40:59

Benzeneheptanoic acid, g,z-dioxo Structure
Benzeneheptanoic acid, g,z-dioxo structure
Common Name Benzeneheptanoic acid, g,z-dioxo
CAS Number 6336-53-4 Molecular Weight 234.24800
Density 1.199g/cm3 Boiling Point 447.8ºC at 760 mmHg
Molecular Formula C13H14O4 Melting Point N/A
MSDS N/A Flash Point 238.7ºC

 Names

Name 4,7-dioxo-7-phenylheptanoic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.199g/cm3
Boiling Point 447.8ºC at 760 mmHg
Molecular Formula C13H14O4
Molecular Weight 234.24800
Flash Point 238.7ºC
Exact Mass 234.08900
PSA 71.44000
LogP 2.08340
Index of Refraction 1.537
InChIKey DCNLNHPQCXZOHD-UHFFFAOYSA-N
SMILES O=C(O)CCC(=O)CCC(=O)c1ccccc1

 Safety Information

HS Code 2918300090

 Synthetic Route

~54%

Benzeneheptanoic acid, g,z-dioxo Structure

Benzeneheptanoi...

CAS#:6336-53-4

Literature: Zhuang, Wei; Ju, Chao-Fan; Zhang, Xiu-Qin; Xiao, Jian; Wang, Kai Asian Journal of Chemistry, 2014 , vol. 26, # 10 p. 3116 - 3118

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Benzeneheptanoic acid, g,z-dioxo Structure

Benzeneheptanoi...

CAS#:6336-53-4

Literature: Thewalt,K.; Rudolph,W. Chemische Berichte, 1963 , vol. 96, p. 136 - 142

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Benzeneheptanoic acid, g,z-dioxo Structure

Benzeneheptanoi...

CAS#:6336-53-4

Literature: Kehrer; Igler Chemische Berichte, 1899 , vol. 32, p. 1176 Full Text Show Details Kehrer Chemische Berichte, 1901 , vol. 34, p. 1266 Chemische Berichte, 1902 , vol. 35, p. 2010

 Customs

HS Code 2918300090
Summary 2918300090 other carboxylic acids with aldehyde or ketone function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:6.5%。General tariff:30.0%

 Benzeneheptanoic acid, g,z-dioxoBioassay

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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: 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: Primary Screen Inhibitors of CD40 Signaling in BL2 Cells Measured in Cell-Based Syste...
Source: Broad Institute
Target: N/A
External Id: 7124-01_Inhibitor_SinglePoint_HTS_Activity
Name: Dicer-mediated maturation of pre-microRNA
Source: Center for Chemical Genomics, University of Michigan
Target: N/A
External Id: TargetID_659_CEMA
Name: Fluorescence-based cell-based primary high throughput screening assay to identify pos...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_PAM_FLUO8_1536_1X%ACT PRUN
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 Synonyms

4,7-Dioxo-7-phenyl-heptansaeure
4,7-dioxo-7-phenyl-heptanoic acid
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