5,6-Dimethyl 1-(4-chlorophenyl)-3a,4,4a,6a,7,7a-hexahydro-4,7-methano-1H-[1,2]diazeto[3,4-f]benzotriazole-5,6-dicarboxylate
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![5,6-Dimethyl 1-(4-chlorophenyl)-3a,4,4a,6a,7,7a-hexahydro-4,7-methano-1H-[1,2]diazeto[3,4-f]benzotriazole-5,6-dicarboxylate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/715e2d2a378240a49ff7398ffc0973f5.png "5,6-Dimethyl 1-(4-chlorophenyl)-3a,4,4a,6a,7,7a-hexahydro-4,7-methano-1H-[1,2]diazeto[3,4-f]benzotriazole-5,6-dicarboxylate")
5,6-Dimethyl 1-(4-chlorophenyl)-3a,4,4a,6a,7,7a-hexahydro-4,7-methano-1H-[1,2]diazeto[3,4-f]benzotriazole-5,6-dicarboxylate
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CAS No:
65244-18-0
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Formula:
C17H18ClN5O4
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Chemical Name:
5,6-Dimethyl 1-(4-chlorophenyl)-3a,4,4a,6a,7,7a-hexahydro-4,7-methano-1H-[1,2]diazeto[3,4-f]benzotriazole-5,6-dicarboxylate
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Synonyms:
4,7-Methano-1H-[1,2]diazeto[3,4-f]benzotriazole-5,6-dicarboxylic acid,1-(4-chlorophenyl)-3a,4,4a,6a,7,7a-hexahydro-,5,6-dimethyl ester;4,7-Methano-1H-[1,2]diazeto[3,4-f]benzotriazole-5,6-dicarboxylic acid,1-(4-chlorophenyl)-3a,4,4a,6a,7,7a-hexahydro-,dimethyl ester;5,6-Dimethyl 1-(4-chlorophenyl)-3a,4,4a,6a,7,7a-hexahydro-4,7-methano-1H-[1,2]diazeto[3,4-f]benzotriazole-5,6-dicarboxylate
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CAS No:
5,6-Dimethyl 1-(4-chlorophenyl)-3a,4,4a,6a,7,7a-hexahydro-4,7-methano-1H-[1,2]diazeto[3,4-f]benzotriazole-5,6-dicarboxylate Basic Attributes
391.80900
391.81
265-658-5
Computed Properties
Molecular Weight:391.8
XLogP3:3.3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:3
Exact Mass:391.1047318
Monoisotopic Mass:391.1047318
Topological Polar Surface Area:87
Heavy Atom Count:27
Complexity:684
Undefined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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