3-(1,3-BENZOTHIAZOL-2-YL)PROPANOIC ACID
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3-(1,3-BENZOTHIAZOL-2-YL)PROPANOIC ACID
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CAS No:
29198-86-5
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Formula:
C10H9NO2S
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Chemical Name:
3-(1,3-BENZOTHIAZOL-2-YL)PROPANOIC ACID
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Synonyms:
2-Benzothiazolepropanoicacid(9CI);3-(1,3-benzothiazol-2-yl)propanoic acid(SALTDATA: FREE);2-(2-Carboxyethyl)-1,3-benzothiazole;3-(Benzo[d]thiazol-2-yl)propanoic acid;3-(1,3-benzothiazol-2-yl)propionic acid
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CAS No:
3-(1,3-BENZOTHIAZOL-2-YL)PROPANOIC ACID Basic Attributes
207.2527
207.03500
DTXSID70354380
2934999090
Safety Information
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, 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:207.25
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:207.03539970
Monoisotopic Mass:207.03539970
Topological Polar Surface Area:78.4
Heavy Atom Count:14
Complexity:222
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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3-(1,3-BENZOTHIAZOL-2-YL)PROPANOIC ACID
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