4-(2-carboxybenzoyl)phthalic acid
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4-(2-carboxybenzoyl)phthalic acid
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CAS No:
5466-99-9
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Formula:
C16H10O7
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Chemical Name:
4-(2-carboxybenzoyl)phthalic acid
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Synonyms:
NSC28620;4-(2-carboxybenzoyl)phthalic acid;5466-99-9;NSC-28620;Compound 28620;NCIStruc1_001017;NCIStruc2_001156;1,2-Benzenedicarboxylicacid, 4-(2-carboxybenzoyl)-;1,2-Benzenedicarboxylic acid, 4-(2-carboxybenzoyl)-;SCHEMBL2058645;CHEMBL1414990;BDBM26617;DTXSID70282891;ZINC394912;NCI28620;CCG-36796;NCGC00013354;AKOS024333975;MCULE-2919031517;NCGC00013354-02;NCGC00096471-01;NCI60_002348;2',3,4-BENZOPHENONETRICARBOXYLIC ACID;4-[(2-carboxyphenyl)carbonyl]benzene-1,2-dicarboxylic acid
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CAS No:
4-(2-carboxybenzoyl)phthalic acid Basic Attributes
314.25 g/mol
314.04265265 g/mol
28620
DTXSID70282891
Safety Information
|Warning|H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]|P261, P272, P280, P302+P352, P321, P333+P313, P363, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:314.25
XLogP3:1.8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:314.04265265
Monoisotopic Mass:314.04265265
Topological Polar Surface Area:129
Heavy Atom Count:23
Complexity:513
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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