3-[3-(4-Methylphenyl)-2,1-benzisoxazol-5-yl]-2-propenoic acid
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![3-[3-(4-Methylphenyl)-2,1-benzisoxazol-5-yl]-2-propenoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/8ad7b5415f974976b3680563e75e8735.png "3-[3-(4-Methylphenyl)-2,1-benzisoxazol-5-yl]-2-propenoic acid")
3-[3-(4-Methylphenyl)-2,1-benzisoxazol-5-yl]-2-propenoic acid
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CAS No:
344276-77-3
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Formula:
C17H13NO3
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Chemical Name:
3-[3-(4-Methylphenyl)-2,1-benzisoxazol-5-yl]-2-propenoic acid
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Synonyms:
2-Propenoic acid,3-[3-(4-methylphenyl)-2,1-benzisoxazol-5-yl]-;3-[3-(4-Methylphenyl)-2,1-benzisoxazol-5-yl]-2-propenoic acid
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CAS No:
Computed Properties
Molecular Weight:279.29
XLogP3:3.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:279.08954328
Monoisotopic Mass:279.08954328
Topological Polar Surface Area:63.3
Heavy Atom Count:21
Complexity:401
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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