2-PHENYLLEVULINICACID
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2-PHENYLLEVULINICACID
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CAS No:
4439-87-6
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Formula:
C11H12O3
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Chemical Name:
2-PHENYLLEVULINICACID
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Synonyms:
2-PHENYLLEVULINICACID;4-oxo-2-phenylpentanoicacid;4-keto-2-phenyl-valericacid;4-oxo-2-phenyl-pentanoicacid
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CAS No:
Safety Information
R36/37/38
26-36/37/39
P264, P280, P305+P351+P338, P33, P313
H319
|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:192.21
XLogP3:1.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:192.078644241
Monoisotopic Mass:192.078644241
Topological Polar Surface Area:54.4
Heavy Atom Count:14
Complexity:217
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes