4-(2,3-DIHYDRO-1,4-BENZODIOXIN-6-YLAMINO)-4-OXOBUTANOIC ACID
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4-(2,3-DIHYDRO-1,4-BENZODIOXIN-6-YLAMINO)-4-OXOBUTANOIC ACID
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CAS No:
331461-05-3
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Formula:
C12H13NO5
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Chemical Name:
4-(2,3-DIHYDRO-1,4-BENZODIOXIN-6-YLAMINO)-4-OXOBUTANOIC ACID
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Synonyms:
3-[(2,3-dihydro-1,4-benzodioxin-6-yl)carbamoyl]propanoic acid;Oprea1_205057;KS-00003LER;4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-4-oxobutanoic acid;ZINC4118332;AKOS002685324;JS-0556;MCULE-1756882426;ST028886;3-(N-(2H,3H-benzo[3,4-e]1,4-dioxan-6-yl)carbamoyl)propanoic acid
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CAS No:
Computed Properties
Molecular Weight:251.23
XLogP3:0.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:251.07937252
Monoisotopic Mass:251.07937252
Topological Polar Surface Area:84.9
Heavy Atom Count:18
Complexity:320
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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