Benzoic acid,3,3'-methylenebis[6-hydroxy-5-methyl-

Modify Date: 2024-04-02 19:52:59

Benzoic acid,3,3'-methylenebis[6-hydroxy-5-methyl- Structure
Benzoic acid,3,3'-methylenebis[6-hydroxy-5-methyl- structure
Common Name Benzoic acid,3,3'-methylenebis[6-hydroxy-5-methyl-
CAS Number 2581-36-4 Molecular Weight 316.30500
Density 1.416g/cm3 Boiling Point 560.4ºC at 760mmHg
Molecular Formula C17H16O6 Melting Point N/A
MSDS N/A Flash Point 306.8ºC

 Names

Name 5-[(3-carboxy-4-hydroxy-5-methylphenyl)methyl]-2-hydroxy-3-methylbenzoic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.416g/cm3
Boiling Point 560.4ºC at 760mmHg
Molecular Formula C17H16O6
Molecular Weight 316.30500
Flash Point 306.8ºC
Exact Mass 316.09500
PSA 115.06000
LogP 2.70180
Vapour Pressure 2.15E-13mmHg at 25°C
Index of Refraction 1.664

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
GP4200000
CHEMICAL NAME :
2,3-Cresotic acid, 5,5'-methylenedi-
CAS REGISTRY NUMBER :
2581-36-4
BEILSTEIN REFERENCE NO. :
3433298
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C17-H16-O6
MOLECULAR WEIGHT :
316.33
WISWESSER LINE NOTATION :
QVR BQ C1 E1R DQ C1 EVQ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CBCCT* "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. (National Academy of Science Library, 2101 Constitution Ave., NW, Washington, DC 20418) Volume(issue)/page/year: 7,779,1955

 Synthetic Route

~99%

Benzoic acid,3,3'-methylenebis[6-hydroxy-5-methyl- Structure

Benzoic acid,3,...

CAS#:2581-36-4

Literature: Cushman, Mark; Kanamathareddy, Suseela; Clerq, Erik de; Schols, Dominique; Goldman, Mark E.; Bowen, Julie A. Journal of Medicinal Chemistry, 1991 , vol. 34, # 1 p. 337 - 342

~%

Benzoic acid,3,3'-methylenebis[6-hydroxy-5-methyl- Structure

Benzoic acid,3,...

CAS#:2581-36-4

Literature: Shrestha, Suja; Bhattarai, Bharat Raj; Chang, Kyung Ja; Lee, Keun-Hyeung; Cho, Hyeongjin Bioorganic and Medicinal Chemistry Letters, 2007 , vol. 17, # 10 p. 2760 - 2764

~%

Benzoic acid,3,3'-methylenebis[6-hydroxy-5-methyl- Structure

Benzoic acid,3,...

CAS#:2581-36-4

Literature: Kahl Chemische Berichte, 1898 , vol. 31, p. 146 Full Text Show Details Geigy and Co. Patent: DE49970 ; Fortschr. Teerfarbenfabr. Verw. Industriezweige, vol. 2, p. 50

 Synonyms

o-Cresotic acid,5,5'-methylenedi
di(3-carboxy-4-hydroxy-5-methyl)methane
4.4'-Dioxy-5.5'-dimethyl-diphenylmethan-dicarbonsaeure-(3.3')
6,6'-Dihydroxy-5,5'-dimethyl-3,3'-methandiyl-di-benzoesaeure
3,3'-dicarboxy-4,4'-dihydroxy-5,5'-dimethyldiphenylmethane
5,5'-Methylenedi-2,3-cresotic acid
6,6'-dihydroxy-5,5'-dimethyl-3,3'-methanediyl-di-benzoic acid
Methylen-di-o-kresotinsaeure
2,3-CRESOTIC ACID,5,5'-METHYLENEDI
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