CAS 60547-63-9|1-Acetyltagitinin A

Introduction:Basic information about CAS 60547-63-9|1-Acetyltagitinin A, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common Name1-Acetyltagitinin A
CAS Number60547-63-9Molecular Weight410.458
Density1.2±0.1 g/cm3Boiling Point532.1±50.0 °C at 760 mmHg
Molecular FormulaC21H30O8Melting Point/
MSDS/Flash Point179.4±23.6 °C

Names

Name1-Acetyltagitinin A
SynonymMore Synonyms

Chemical & Physical Properties

Density1.2±0.1 g/cm3
Boiling Point532.1±50.0 °C at 760 mmHg
Molecular FormulaC21H30O8
Molecular Weight410.458
Flash Point179.4±23.6 °C
Exact Mass410.194061
PSA108.36000
LogP1.70
Vapour Pressure0.0±3.2 mmHg at 25°C
Index of Refraction1.528
InChIKeyMFYNTWZAYXDJQB-VQHMBOPWSA-N
SMILESC=C1C(=O)OC2CC(C)C3(O)CC(OC(C)=O)C(C)(CC(OC(=O)C(C)C)C12)O3

Safety Information

Hazard CodesXi

Synonyms

(1S,2S,4R,8S,9R,12R)-12-Acetoxy-1-hydroxy-2,11-dimethyl-7-methylene-6-oxo-5,14-dioxatricyclo[9.2.1.0]tetradec-9-yl 2-methylpropanoate
Propanoic acid, 2-methyl-, (3aS,4R,6S,7R,9S,10S,11aR)-7-(acetyloxy)dodecahydro-9-hydroxy-6,10-dimethyl-3-methylene-2-oxo-6,9-epoxycyclodeca[b]furan-4-yl ester
Propanoic acid, 2-methyl-, (3aS,4R,7R,9S,10S,11aR)-7-(acetyloxy)dodecahydro-9-hydroxy-6,10-dimethyl-3-methylene-2-oxo-6,9-epoxycyclodeca[b]furan-4-yl ester
(1S,2S,4R,8S,9R,11S,12R)-12-Acetoxy-1-hydroxy-2,11-dimethyl-7-methylene-6-oxo-5,14-dioxatricyclo[9.2.1.0]tetradec-9-yl 2-methylpropanoate
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