(E)-4-(1,3-BENZOXAZOL-6-YLAMINO)-4-OXO-2-BUTENOIC ACID
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(E)-4-(1,3-BENZOXAZOL-6-YLAMINO)-4-OXO-2-BUTENOIC ACID
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CAS No:
860785-22-4
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Formula:
C11H8N2O4
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Chemical Name:
(E)-4-(1,3-BENZOXAZOL-6-YLAMINO)-4-OXO-2-BUTENOIC ACID
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Synonyms:
(2E)-3-[(1,3-benzoxazol-6-yl)carbamoyl]prop-2-enoic acid;(E)-4-(1,3-benzoxazol-6-ylamino)-4-oxo-2-butenoic acid;ZINC2509215;AKOS005081431;12T-0860
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CAS No:
Computed Properties
Molecular Weight:232.19
XLogP3:0.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:232.04840674
Monoisotopic Mass:232.04840674
Topological Polar Surface Area:92.4
Heavy Atom Count:17
Complexity:342
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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