4-[2-hydroxy-4-(4-hydroxy-2-methoxy-3,5,6-trimethylbenzoyl)oxy-3,5,6-trimethylbenzoyl]oxy-2-methoxy-3,5,6-trimethylbenzoic acid

Modify Date: 2024-04-09 16:37:48

4-[2-hydroxy-4-(4-hydroxy-2-methoxy-3,5,6-trimethylbenzoyl)oxy-3,5,6-trimethylbenzoyl]oxy-2-methoxy-3,5,6-trimethylbenzoic acid Structure
4-[2-hydroxy-4-(4-hydroxy-2-methoxy-3,5,6-trimethylbenzoyl)oxy-3,5,6-trimethylbenzoyl]oxy-2-methoxy-3,5,6-trimethylbenzoic acid structure
 Common Name 4-[2-hydroxy-4-(4-hydroxy-2-methoxy-3,5,6-trimethylbenzoyl)oxy-3,5,6-trimethylbenzoyl]oxy-2-methoxy-3,5,6-trimethylbenzoic acid
CAS Number 158792-23-5 Molecular Weight 580.62200
Density 1.261g/cm3 Boiling Point 825.9ºC at 760mmHg
Molecular Formula C32H36O10 Melting Point N/A
MSDS N/A Flash Point 265ºC

 Names

Name 4-[2-hydroxy-4-(4-hydroxy-2-methoxy-3,5,6-trimethylbenzoyl)oxy-3,5,6-trimethylbenzoyl]oxy-2-methoxy-3,5,6-trimethylbenzoic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.261g/cm3
Boiling Point 825.9ºC at 760mmHg
Molecular Formula C32H36O10
Molecular Weight 580.62200
Flash Point 265ºC
Exact Mass 580.23100
PSA 148.82000
LogP 6.02720
Vapour Pressure 6.83E-29mmHg at 25°C
Index of Refraction 1.598
InChIKey UESGSZFVMHDIFM-UHFFFAOYSA-N
SMILES COc1c(C)c(O)c(C)c(C)c1C(=O)Oc1c(C)c(C)c(C(=O)Oc2c(C)c(C)c(C(=O)O)c(OC)c2C)c(O)c1C

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DH2216500
CHEMICAL NAME :
Benzoic acid, 2-hydroxy-4-((4-hydroxy-2-methoxy-3,5,6-trimethylbenz oyl)oxy)-3,5,6-trimet hyl-, 4-carboxy-3-methoxy-2,5,6-trimethylphenyl ester
CAS REGISTRY NUMBER :
158792-23-5
LAST UPDATED :
199703
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C32-H36-O10
MOLECULAR WEIGHT :
580.68

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
>300 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JANTAJ Journal of Antibiotics. (Japan Antibiotics Research Assoc., 2-20-8 Kamiosaki, Shinagawa-ku, Tokyo, 141, Japan) V.2-5, 1948-52; V.21- 1968- Volume(issue)/page/year: 47,1175,1994

 Synonyms

ps 990
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Chemsrc provides CAS#:158792-23-5 MSDS, density, melting point, boiling point, structure, etc. Its name is 4-[2-hydroxy-4-(4-hydroxy-2-methoxy-3,5,6-trimethylbenzoyl)oxy-3,5,6-trimethylbenzoyl]oxy-2-methoxy-3,5,6-trimethylbenzoic acid>> amp version: 4-[2-hydroxy-4-(4-hydroxy-2-methoxy-3,5,6-trimethylbenzoyl)oxy-3,5,6-trimethylbenzoyl]oxy-2-methoxy-3,5,6-trimethylbenzoic acid

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