ASISCHEM C75274
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ASISCHEM C75274
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CAS No:
339551-18-7
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Formula:
C11H11NO3S
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Chemical Name:
ASISCHEM C75274
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Synonyms:
2-(1,3-BENZOXAZOL-2-YLTHIO)BUTANOIC ACID;2-(1,3-benzoxazol-2-ylthio)butanoic acid(SALTDATA: FREE);ASISCHEM C75274;CHEMBRDG-BB 5851404
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CAS No:
Computed Properties
Molecular Weight:237.28
XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:237.04596439
Monoisotopic Mass:237.04596439
Topological Polar Surface Area:88.6
Heavy Atom Count:16
Complexity:262
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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