Butanoic acid, 2-cyano-3-fluoro-2-hydroxy-3-methyl-, ethyl ester (9CI)
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Butanoic acid, 2-cyano-3-fluoro-2-hydroxy-3-methyl-, ethyl ester (9CI)
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CAS No:
153431-42-6
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Formula:
C8H12FNO3
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Chemical Name:
Butanoic acid, 2-cyano-3-fluoro-2-hydroxy-3-methyl-, ethyl ester (9CI)
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Synonyms:
Butanoic acid, 2-cyano-3-fluoro-2-hydroxy-3-methyl-, ethyl ester (9CI)
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CAS No:
Butanoic acid, 2-cyano-3-fluoro-2-hydroxy-3-methyl-, ethyl ester (9CI) Basic Attributes
189.1841832
189.08
Computed Properties
Molecular Weight:189.18
XLogP3:0.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:189.08012141
Monoisotopic Mass:189.08012141
Topological Polar Surface Area:70.3
Heavy Atom Count:13
Complexity:255
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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