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2-PHENYLLEVULINICACID

2-PHENYLLEVULINICACID structure

2-PHENYLLEVULINICACID 

structure
  • CAS No:

    4439-87-6

  • Formula:

    C11H12O3

  • Chemical Name:

    2-PHENYLLEVULINICACID

  • Synonyms:

    2-PHENYLLEVULINICACID;4-oxo-2-phenylpentanoicacid;4-keto-2-phenyl-valericacid;4-oxo-2-phenyl-pentanoicacid

2-PHENYLLEVULINICACID Basic Attributes

192.21100

192.07900

65632

DTXSID70289926

2918300090

Characteristics

54.37000

1.83390

1.17g/cm3

127ºC

327.7ºC at 760mmHg

166.2ºC

1.536

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

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