2-(2-Benzothiazolylthio)acetic acid
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2-(2-Benzothiazolylthio)acetic acid
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CAS No:
6295-57-4
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Formula:
C9H7NO2S2
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Chemical Name:
2-(2-Benzothiazolylthio)acetic acid
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Synonyms:
Acetic acid,2-(2-benzothiazolylthio)-;Acetic acid,(2-benzothiazolylthio)-;2-(2-Benzothiazolylthio)acetic acid;S-2-Benzothiazolylthioglycolic acid;2-Carboxymethylthiobenzothiazole;(2-Benzothiazolylthio)acetic acid;Sanbit ABT;NSC 11891;NSC 4443;(1,3-Benzothiazol-2-ylsulfanyl)acetic acid;2-(Benzo[d]thiazol-2-ylthio)acetic acid;2-(1,3-Benzothiazol-2-ylsulfanyl)acetic acid
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CAS No:
2-(2-Benzothiazolylthio)acetic acid Basic Attributes
225.29
225.29
228-565-0
9H400WTE52
11891
DTXSID5064209
2934999090
Characteristics
104
2.74
1.5±0.1 g/cm3
156-157 °C
423.4±47.0 °C at 760 mmHg
209.9±29.3 °C
1.727
>33.8 [ug/mL]
Safety Information
IRRITANT
36/37/38
26-36/37/39
Xi
P264, P270, P273, P280, P301+P312, P305+P351+P338, P330, P337+P313, P391, P501
H302
|Danger|H302 (98.04%): Harmful if swallowed [Warning Acute toxicity, oral]|P201, P202, P264, P270, P273, P280, P281, P301+P312, P305+P351+P338, P308+P313, P310, P330, P337+P313, P391, P405, and P501|Aggregated GHS information provided by 51 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
2-(2-Benzothiazolylthio)acetic acid Use and Manufacturing
Acetic acid, 2-(2-benzothiazolylthio)-: ACTIVE
Computed Properties
Molecular Weight:225.3
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:224.99182081
Monoisotopic Mass:224.99182081
Topological Polar Surface Area:104
Heavy Atom Count:14
Complexity:225
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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2-(2-Benzothiazolylthio)acetic acid
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