6,7,7-trimethyltricyclo[6.2.1.01,5]undec-5-ene-2-carboxylic acid
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![6,7,7-trimethyltricyclo[6.2.1.01,5]undec-5-ene-2-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/d91e721c4ec740738afbe16df2526b09.png "6,7,7-trimethyltricyclo[6.2.1.01,5]undec-5-ene-2-carboxylic acid")
6,7,7-trimethyltricyclo[6.2.1.01,5]undec-5-ene-2-carboxylic acid
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CAS No:
16202-79-2
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Formula:
C15H22O2
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Chemical Name:
6,7,7-trimethyltricyclo[6.2.1.01,5]undec-5-ene-2-carboxylic acid
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Synonyms:
ISOZIZANOIC ACID;16202-79-2;Isokhusenic acid;DTXSID30936626;1H-3a,6-Methanoazulene-3-carboxylic acid, 2,3,4,5,6,7-hexahydro-7,7,8-trimethyl-, [3S-(3.alpha.,3a.alpha.,6.alpha.)]-;1H-3a.alpha.,6-Methanoazulene-3-carboxylic acid, 2,3.beta.,4,5,6.beta.,7-hexahydro-7,7,8-trimethyl-;6,7,7-Trimethyl-tricyclo[6.2.1.01,5 ]undec-5-en-2-yl carboxylic acid;7,7,8-trimethyl-2,3,4,5,6,7-hexahydro-1H-3a,6-methanoazulene-3-carboxylic acid;(3S,3aS,6R)-7,7,8-Trimethyl-2,3,4,5,6,7-hexahydro-1H-3a,6-methanoazulene-3-carboxylic acid;1H-3a,6-Methanoazulene-3-carboxylic acid, 2,3,4,5,6,7-hexahydro-7,7,8-trimethyl-, (3S,3aS,6R)-
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CAS No:
6,7,7-trimethyltricyclo[6.2.1.01,5]undec-5-ene-2-carboxylic acid Basic Attributes
234.33 g/mol
234.161979940 g/mol
Computed Properties
Molecular Weight:234.33
XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:234.161979940
Monoisotopic Mass:234.161979940
Topological Polar Surface Area:37.3
Heavy Atom Count:17
Complexity:419
Undefined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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