3-[(5-methylthiophen-2-yl)methylamino]benzoic acid
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![3-[(5-methylthiophen-2-yl)methylamino]benzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/3aebf7ce2bd241db9a765612f800fcb8.png "3-[(5-methylthiophen-2-yl)methylamino]benzoic acid")
3-[(5-methylthiophen-2-yl)methylamino]benzoic acid
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CAS No:
869950-50-5
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Formula:
C13H13NO2S
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Chemical Name:
3-[(5-methylthiophen-2-yl)methylamino]benzoic acid
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CAS No:
3-[(5-methylthiophen-2-yl)methylamino]benzoic acid Basic Attributes
247.31300
247.06669983 g/mol
DTXSID70358803
2934999090
Computed Properties
Molecular Weight:247.31
XLogP3:3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:247.06669983
Monoisotopic Mass:247.06669983
Topological Polar Surface Area:77.6
Heavy Atom Count:17
Complexity:272
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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