2-(thiophen-2-ylmethylamino)benzoic acid
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2-(thiophen-2-ylmethylamino)benzoic acid
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CAS No:
18210-20-3
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Formula:
C12H11NO2S
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Chemical Name:
2-(thiophen-2-ylmethylamino)benzoic acid
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Synonyms:
2-(thiophen-2-ylmethyl-amino)-benzoic acid; 2-[(2-thienylmethyl)amino]benzoic acid;
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CAS No:
2-(thiophen-2-ylmethylamino)benzoic acid Basic Attributes
233.28600
233.05104977
DTXSID90424271
2934999090
Characteristics
77.57000
3.13140
1.359g/cm3
416.4ºC at 760 mmHg
205.6ºC
1.691
23.8 [ug/mL]
1.11E-07mmHg at 25°C
Computed Properties
Molecular Weight:233.29
XLogP3:3.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:233.05104977
Monoisotopic Mass:233.05104977
Topological Polar Surface Area:77.6
Heavy Atom Count:16
Complexity:247
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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