4-[[(AMINOCARBONYL)AMINO]METHYL]BENZOIC ACID
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![4-[[(AMINOCARBONYL)AMINO]METHYL]BENZOIC ACID structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/2b9247c2c90549deae377e3f7f8b9630.png "4-[[(AMINOCARBONYL)AMINO]METHYL]BENZOIC ACID")
4-[[(AMINOCARBONYL)AMINO]METHYL]BENZOIC ACID
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CAS No:
1052544-66-7
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Formula:
C9H10N2O3
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Chemical Name:
4-[[(AMINOCARBONYL)AMINO]METHYL]BENZOIC ACID
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Synonyms:
6-fluoro-3,4-dihydro-2H-thiochromen-4-ylamine hydrochloride;6-fluoro-3,4-dihydro-2H-thiochromen-4-amine;hydrochloride;6-fluoro-3,4-dihydro-2H-1-benzothiopyran-4-amine hydrochloride;SCHEMBL1003456;CTK7C1420;AKOS024015344;MCULE-1277593960;6-Fluorothiochroman-4-amine hydrochloride;EN300-15181;J-518717
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CAS No:
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:219.71
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Exact Mass:219.0284764
Monoisotopic Mass:219.0284764
Topological Polar Surface Area:51.3
Heavy Atom Count:13
Complexity:165
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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4-[[(AMINOCARBONYL)AMINO]METHYL]BENZOIC ACID
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