1-oxoisothiochromene-3-carboxylic acid
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1-oxoisothiochromene-3-carboxylic acid
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CAS No:
4361-85-7
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Formula:
C10H6O3S
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Chemical Name:
1-oxoisothiochromene-3-carboxylic acid
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Synonyms:
1-Oxo-1H-isothiochromene-3-carboxylic acid;4361-85-7;NSC403261;1-oxoisothiochromene-3-carboxylic acid;UNII-SZ2QF39N41;SZ2QF39N41;1-oxobenzo[c]thiin-3-carboxylic acid;NSC 403261;MLS000570407;SCHEMBL6836536;CHEMBL1506240;ZINC79372;DTXSID40195888;HMS1619O19;HMS2312D17;2-Thiaisocoumarin-3-carboxylic acid;MFCD04066444;SBB039707;STK950574;1-oxo-1h-isothiochromene-3-carboxylic;AKOS000268020;CCG-121458;MCULE-4240347478;NSC-403261;2- Thiaisocoumarin -3- carboxylic acid;NCGC00246167-01;SMR000150399;ST50069474;1-Oxo-1H-2-benzothiopyran-3-carboxylic acid;BRD-K06759010-001-07-3;F1553-0061
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CAS No:
1-oxoisothiochromene-3-carboxylic acid Basic Attributes
206.22 g/mol
206.00376522 g/mol
SZ2QF39N41
403261
DTXSID40195888
Computed Properties
Molecular Weight:206.22
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:206.00376522
Monoisotopic Mass:206.00376522
Topological Polar Surface Area:79.7
Heavy Atom Count:14
Complexity:309
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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