4-[[(1H-Benzotriazol-1-ylmethyl)amino]sulfonyl]benzoic acid
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![4-[[(1H-Benzotriazol-1-ylmethyl)amino]sulfonyl]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/505ca24418de42c198ca6fef2e2b26e9.png "4-[[(1H-Benzotriazol-1-ylmethyl)amino]sulfonyl]benzoic acid")
4-[[(1H-Benzotriazol-1-ylmethyl)amino]sulfonyl]benzoic acid
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CAS No:
170292-97-4
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Formula:
C14H12N4O4S
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Chemical Name:
4-[[(1H-Benzotriazol-1-ylmethyl)amino]sulfonyl]benzoic acid
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Synonyms:
Benzoic acid,4-[[(1H-benzotriazol-1-ylmethyl)amino]sulfonyl]-;4-[[(1H-Benzotriazol-1-ylmethyl)amino]sulfonyl]benzoic acid
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CAS No:
4-[[(1H-Benzotriazol-1-ylmethyl)amino]sulfonyl]benzoic acid Basic Attributes
332.33400
332.33
416-470-9|605-575-7
DTXSID50598624
Safety Information
|Warning|H319: Causes serious eye irritation [Warning Serious eye damage/eye irritation]|P264, P273, P280, P305+P351+P338, P337+P313, P391, and P501
Computed Properties
Molecular Weight:332.34
XLogP3:1.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:332.05792605
Monoisotopic Mass:332.05792605
Topological Polar Surface Area:123
Heavy Atom Count:23
Complexity:527
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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