1-Methyl-1-[(3S,5R,8S)-1,2,3,4,5,6,7,8-octahydro-3,8-dimethyl-5-azulenyl]ethyl butanoate
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1-Methyl-1-[(3S,5R,8S)-1,2,3,4,5,6,7,8-octahydro-3,8-dimethyl-5-azulenyl]ethyl butanoate
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CAS No:
73003-91-5
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Formula:
C19H32O2
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Chemical Name:
1-Methyl-1-[(3S,5R,8S)-1,2,3,4,5,6,7,8-octahydro-3,8-dimethyl-5-azulenyl]ethyl butanoate
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Synonyms:
Butanoic acid,1-methyl-1-[(3S,5R,8S)-1,2,3,4,5,6,7,8-octahydro-3,8-dimethyl-5-azulenyl]ethyl ester;Butanoic acid,1-methyl-1-(1,2,3,4,5,6,7,8-octahydro-3,8-dimethyl-5-azulenyl)ethyl ester,[3S-(3α,5α,8α)]-;1-Methyl-1-[(3S,5R,8S)-1,2,3,4,5,6,7,8-octahydro-3,8-dimethyl-5-azulenyl]ethyl butanoate
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CAS No:
1-Methyl-1-[(3S,5R,8S)-1,2,3,4,5,6,7,8-octahydro-3,8-dimethyl-5-azulenyl]ethyl butanoate Basic Attributes
292.5 g/mol
292.46
277-213-2
BXX9GGI596
1-Methyl-1-[(3S,5R,8S)-1,2,3,4,5,6,7,8-octahydro-3,8-dimethyl-5-azulenyl]ethyl butanoate Use and Manufacturing
Butanoic acid, 1-methyl-1-[(3S,5R,8S)-1,2,3,4,5,6,7,8-octahydro-3,8-dimethyl-5-azulenyl]ethyl ester: INACTIVE
Computed Properties
Molecular Weight:292.5
XLogP3:4.5
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:292.240230259
Monoisotopic Mass:292.240230259
Topological Polar Surface Area:26.3
Heavy Atom Count:21
Complexity:419
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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