Valeriandoid B

Modify Date: 2024-04-05 23:35:23

Valeriandoid B Structure
Valeriandoid B structure
Common Name Valeriandoid B
CAS Number 1380399-57-4 Molecular Weight 516.966
Density 1.3±0.1 g/cm3 Boiling Point 562.9±50.0 °C at 760 mmHg
Molecular Formula C24H33ClO10 Melting Point N/A
MSDS N/A Flash Point 294.2±30.1 °C

 Names

Name (1S,6S,7S,7aS)-4-(acetoxymethyl)-7-(chloromethyl)-7-hydroxy-1-((3-methylbutanoyl)oxy)-1,6,7,7a-tetrahydrocyclopenta[c]pyran-6-yl 3-acetoxy-3-methylbutanoate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.3±0.1 g/cm3
Boiling Point 562.9±50.0 °C at 760 mmHg
Molecular Formula C24H33ClO10
Molecular Weight 516.966
Flash Point 294.2±30.1 °C
Exact Mass 516.176208
PSA 134.66000
LogP 2.01
Vapour Pressure 0.0±3.5 mmHg at 25°C
Index of Refraction 1.531

 Safety Information

Hazard Codes Xi

 Synonyms

Butanoic acid, 3-(acetyloxy)-3-methyl-, (1S,6S,7S,7aS)-4-[(acetyloxy)methyl]-7-(chloromethyl)-1,6,7,7a-tetrahydro-7-hydroxy-1-(3-methyl-1-oxobutoxy)cyclopenta[c]pyran-6-yl ester
(1S,6S,7S,7aS)-4-(Acetoxymethyl)-7-(chloromethyl)-7-hydroxy-1-[(3-methylbutanoyl)oxy]-1,6,7,7a-tetrahydrocyclopenta[c]pyran-6-yl 3-acetoxy-3-methylbutanoate