5H-Cyclopropa[3,4]benz[1,2-e]azulen-5-one,9,9a-bis(benzoyloxy)-1,1a,1b,4,4a,7a,7b,8,9,9a-decahydro-4a,7b-dihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-,(1aR,1bS,4aR,7aS,7bS,8R,9R,9aS)

Modify Date: 2025-08-28 19:18:12

5H-Cyclopropa[3,4]benz[1,2-e]azulen-5-one,9,9a-bis(benzoyloxy)-1,1a,1b,4,4a,7a,7b,8,9,9a-decahydro-4a,7b-dihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-,(1aR,1bS,4aR,7aS,7bS,8R,9R,9aS) Structure
5H-Cyclopropa[3,4]benz[1,2-e]azulen-5-one,9,9a-bis(benzoyloxy)-1,1a,1b,4,4a,7a,7b,8,9,9a-decahydro-4a,7b-dihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-,(1aR,1bS,4aR,7aS,7bS,8R,9R,9aS) structure
Common Name 5H-Cyclopropa[3,4]benz[1,2-e]azulen-5-one,9,9a-bis(benzoyloxy)-1,1a,1b,4,4a,7a,7b,8,9,9a-decahydro-4a,7b-dihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-,(1aR,1bS,4aR,7aS,7bS,8R,9R,9aS)
CAS Number 25405-85-0 Molecular Weight 572.64500
Density 1.37g/cm3 Boiling Point 725.7ºC at 760mmHg
Molecular Formula C34H36O8 Melting Point N/A
MSDS N/A Flash Point 231.2ºC

 Names

Name 5H-Cyclopropa[3,4]benz[1,2-e]azulen-5-one, 9,9a-bis(benzoyloxy)-1,1a,1b,4,4a,7a,7b,8,9,9a-decahydro-4a,7b-dihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.37g/cm3
Boiling Point 725.7ºC at 760mmHg
Molecular Formula C34H36O8
Molecular Weight 572.64500
Flash Point 231.2ºC
Exact Mass 572.24100
PSA 130.36000
LogP 3.65950
Vapour Pressure 4.15E-22mmHg at 25°C
Index of Refraction 1.653
InChIKey FQHYQCXMFZHLAE-PNEATKGUSA-N
SMILES CC1=CC2C(O)(CC(CO)=CC3C4C(C)(C)C4(OC(=O)c4ccccc4)C(OC(=O)c4ccccc4)C(C)C32O)C1=O

 Bioassay

View more

Name: Toxicity against Swiss-Webster mouse assessed as irritation in ear per 5 ul after 24 ...
Source: ChEMBL
Target: Mus musculus
External Id: CHEMBL979469
Name: Toxicity against Swiss-Webster mouse assessed as irritation in ear per 5 ul after 4 h...
Source: ChEMBL
Target: Mus musculus
External Id: CHEMBL979468
Name: HIV Cellular Data
Source: NIAID
Target: N/A
External Id: HIV Cellular Data
Total 3, Current Page 1 of 1
1

 Synonyms

Phorbol-12,13-dibenzoat
Phorbol dibenzoate
PHORBOL 12,13-DIBENZOATE
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