3-methyl-1,2,3,3a,4,5,6,6a-octahydropentalene-1-carboxylic acid
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3-methyl-1,2,3,3a,4,5,6,6a-octahydropentalene-1-carboxylic acid
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CAS No:
28645-03-6
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Formula:
C10H16O2
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Chemical Name:
3-methyl-1,2,3,3a,4,5,6,6a-octahydropentalene-1-carboxylic acid
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Synonyms:
(+-)-3c-Methyl-(3ar,6ac)-octahydro-pentalen-1c-carbonsaeure; exo-2-Methyl-exo-cis-bicyclo<3.3.0>octan-4-carbonsaeure; (+-)-3c-methyl-(3ar,6ac)-octahydro-pentalene-1c-carboxylic acid; 3-methyl-octahydropentalene-1-carboxylic acid; OCTAHYDRO-3-METHYL-1-PENTALENE CARBOXYLIC ACID;
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CAS No:
3-methyl-1,2,3,3a,4,5,6,6a-octahydropentalene-1-carboxylic acid Basic Attributes
168.23300
168.115029749 g/mol
2916399090
Computed Properties
Molecular Weight:168.23
XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:168.115029749
Monoisotopic Mass:168.115029749
Topological Polar Surface Area:37.3
Heavy Atom Count:12
Complexity:200
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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