4-(thiophen-2-ylmethylideneamino)benzoic acid
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4-(thiophen-2-ylmethylideneamino)benzoic acid
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CAS No:
18015-03-7
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Formula:
C12H9NO2S
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Chemical Name:
4-(thiophen-2-ylmethylideneamino)benzoic acid
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Synonyms:
4-(thiophen-2-ylmethylideneamino)benzoic acid;18015-03-7;NSC209074;Maybridge3_001082;CBDivE_002511;SCHEMBL13560869;ZINC94557;DTXSID00308790;HMS1434B04;CCG-45523;ZINC15636463;AKOS024334931;MCULE-9982782252;NSC-209074;4-(2-Thienylmethyleneamino)benzoic acid;IDI1_012469;4-[(2-Thienylmethylene)amino]benzoic acid;DS-005114;Benzoic acid, 4-[(2-thienylmethylene)amino]-;4-{[(E)-2-thienylmethylidene]amino}benzoic acid;SR-01000196213;SR-01000196213-1;SR-01000635280-1;4-[(THIOPHEN-2-YLMETHYLIDENE)AMINO]BENZOIC ACID
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CAS No:
4-(thiophen-2-ylmethylideneamino)benzoic acid Basic Attributes
231.27 g/mol
231.03539970 g/mol
209074
DTXSID00308790
Safety Information
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:231.27
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:231.03539970
Monoisotopic Mass:231.03539970
Topological Polar Surface Area:77.9
Heavy Atom Count:16
Complexity:272
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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