2-(2-aminoethylsulfanyl)benzoic acid
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2-(2-aminoethylsulfanyl)benzoic acid
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CAS No:
14943-94-3
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Formula:
C9H11NO2S
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Chemical Name:
2-(2-aminoethylsulfanyl)benzoic acid
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Synonyms:
2-(2-aminoethylthio)benzoic acid;14943-94-3;2-[(2-aminoethyl)sulfanyl]benzoic acid;2-(2-aminoethylsulfanyl)benzoic acid;PubChem16186;DTXSID70329957;Benzoic acid,2-[(2-aminoethyl)thio]-, hydrochloride (1:1);2-(2-aminoethyl thio)benzoic acid;ALBB-032974;ZINC1702134;AKOS004911648;MCULE-7455628895;73762-44-4;LS-12369;DB-063805;DB-074739;FT-0721370
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CAS No:
2-(2-aminoethylsulfanyl)benzoic acid Basic Attributes
197.26 g/mol
197.05104977 g/mol
DTXSID70329957
Safety Information
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:197.26
XLogP3:-1.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:197.05104977
Monoisotopic Mass:197.05104977
Topological Polar Surface Area:88.6
Heavy Atom Count:13
Complexity:175
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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