2-Methyl-4-phenylbutanoic acid
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2-Methyl-4-phenylbutanoic acid
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CAS No:
1949-41-3
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Formula:
C11H14O2
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Chemical Name:
2-Methyl-4-phenylbutanoic acid
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Synonyms:
Benzenebutanoic acid,α-methyl-;Butyric acid,2-methyl-4-phenyl-;α-Methylbenzenebutanoic acid;2-Methyl-γ-phenylbutyric acid;2-Methyl-4-phenylbutanoic acid;2-Methyl-4-phenylbutyric acid;NSC 402998;143167-63-9;1628063-46-6
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CAS No:
Safety Information
|Warning|H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]|P264, P280, P305+P351+P338, and P337+P313|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:178.23
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:178.099379685
Monoisotopic Mass:178.099379685
Topological Polar Surface Area:37.3
Heavy Atom Count:13
Complexity:160
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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