3-Chloro-4-[(1-methylethyl)sulfonyl]-2-thiophenecarboxylic acid
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![3-Chloro-4-[(1-methylethyl)sulfonyl]-2-thiophenecarboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/a364e777e6c448db81c40e4cf4d80c0c.png "3-Chloro-4-[(1-methylethyl)sulfonyl]-2-thiophenecarboxylic acid")
3-Chloro-4-[(1-methylethyl)sulfonyl]-2-thiophenecarboxylic acid
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CAS No:
175202-26-3
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Formula:
C8H9ClO4S2
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Chemical Name:
3-Chloro-4-[(1-methylethyl)sulfonyl]-2-thiophenecarboxylic acid
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Synonyms:
2-Thiophenecarboxylic acid,3-chloro-4-[(1-methylethyl)sulfonyl]-;3-Chloro-4-[(1-methylethyl)sulfonyl]-2-thiophenecarboxylic acid;3-Chloro-4-(propane-2-sulphonyl)-thiophene-2-carboxylic acid;3-Chloro-4-(propane-2-sulfonyl)thiophene-2-carboxylic acid;3-Chloro-4-(isopropylsulfonyl)thiophene-2-carboxylic acid
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CAS No:
3-Chloro-4-[(1-methylethyl)sulfonyl]-2-thiophenecarboxylic acid Basic Attributes
268.73766
268.74
DTXSID40384836
2934999090
Safety Information
P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, P501
H302+H312+H332
|Warning|H302+H312+H332 (100%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, 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:268.7
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:267.9630788
Monoisotopic Mass:267.9630788
Topological Polar Surface Area:108
Heavy Atom Count:15
Complexity:346
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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3-Chloro-4-[(1-methylethyl)sulfonyl]-2-thiophenecarboxylic acid
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