7-[3-[(4-azido-3-iodophenyl)sulfonylamino]-6,6-dimethyl-2-bicyclo[3.1.1]heptanyl]hept-5-enoic acid
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![7-[3-[(4-azido-3-iodophenyl)sulfonylamino]-6,6-dimethyl-2-bicyclo[3.1.1]heptanyl]hept-5-enoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/fe6ec546e61e4e9dabb0821622fa61ae.png "7-[3-[(4-azido-3-iodophenyl)sulfonylamino]-6,6-dimethyl-2-bicyclo[3.1.1]heptanyl]hept-5-enoic acid")
7-[3-[(4-azido-3-iodophenyl)sulfonylamino]-6,6-dimethyl-2-bicyclo[3.1.1]heptanyl]hept-5-enoic acid
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CAS No:
133190-94-0
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Formula:
C22H29IN4O4S
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Chemical Name:
7-[3-[(4-azido-3-iodophenyl)sulfonylamino]-6,6-dimethyl-2-bicyclo[3.1.1]heptanyl]hept-5-enoic acid
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Synonyms:
(125I)SAP-N3;7-(6,6-dimethyl-3-(4-azido-3-iodobenzenesulfonylamino)bicyclo(3.1.1)hept-2-yl)-5-heptenoic acid;ISAP-N3;133190-94-0;ACMC-1BYBW;5-Heptenoic acid,7-[3-[[(4-azido-3-iodophenyl)sulfonyl]amino]-6,6-dimethylbicyclo[3.1.1]hept-2-yl]-,[1S-[1a,2b(Z),3a,5a]]- (9CI)
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CAS No:
7-[3-[(4-azido-3-iodophenyl)sulfonylamino]-6,6-dimethyl-2-bicyclo[3.1.1]heptanyl]hept-5-enoic acid Basic Attributes
572.5 g/mol
572.09542 g/mol
Computed Properties
Molecular Weight:572.5
XLogP3:6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:10
Exact Mass:572.09542
Monoisotopic Mass:572.09542
Topological Polar Surface Area:106
Heavy Atom Count:32
Complexity:866
Undefined Atom Stereocenter Count:4
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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