4-Amino-2-thiophenecarboxylic acid
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4-Amino-2-thiophenecarboxylic acid
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CAS No:
89499-38-7
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Formula:
C5H5NO2S
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Chemical Name:
4-Amino-2-thiophenecarboxylic acid
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Synonyms:
2-Thiophenecarboxylic acid,4-amino-;4-Amino-2-thiophenecarboxylic acid
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CAS No:
Safety Information
22
Xn
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
4-Amino-2-thiophenecarboxylic acid Use and Manufacturing
4-Amino-2-thiophenecarboxylic Acid, is involved in the preparation of (S)-4-Amino-4,-dihydro-2-thiophenecarboxylic Acid, which is a heterocyclic mimimc of the natural product Gabaculine (G111000), a mechanism-base inactivator ofγ-aminobutyric acid aminotransferase (GABA- AT).
Computed Properties
Molecular Weight:143.17
XLogP3:0.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:143.00409958
Monoisotopic Mass:143.00409958
Topological Polar Surface Area:91.6
Heavy Atom Count:9
Complexity:128
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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4-Amino-2-thiophenecarboxylic acid
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