2-Hydroxy-3-methyl-3-buten-1-oic acid
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2-Hydroxy-3-methyl-3-buten-1-oic acid
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CAS No:
150282-01-2
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Formula:
C5H8O3
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Chemical Name:
2-Hydroxy-3-methyl-3-buten-1-oic acid
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Synonyms:
2-Hydroxy-3-methyl-3-buten-1-oic acid;3-Butenoic acid, 2-hydroxy-3-Methyl-, (R)-;3-Butenoic acid, 2-hydroxy-3-methyl-, (R)- (9CI);(R)-2-Hydroxy-3-methylbut-3-enoic acid
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CAS No:
Characteristics
57.53000
0.00800
1.179±0.06 g/cm3(Predicted)
266.4±20.0 °C(Predicted)
129.2ºC
1.477
0.00118mmHg at 25°C
3.44±0.11(Predicted)
Computed Properties
Molecular Weight:116.11
XLogP3:0.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:116.047344113
Monoisotopic Mass:116.047344113
Topological Polar Surface Area:57.5
Heavy Atom Count:8
Complexity:117
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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