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Home > Encyclopedia > 2-(2-phenylethyl)propanedioic acid

2-(2-phenylethyl)propanedioic acid

2-(2-phenylethyl)propanedioic acid structure

2-(2-phenylethyl)propanedioic acid 

structure
  • CAS No:

    3709-21-5

  • Formula:

    C11H12O4

  • Chemical Name:

    2-(2-phenylethyl)propanedioic acid

  • Synonyms:

    3709-21-5;2-(2-phenylethyl)propanedioic acid;Propanedioic acid, (2-phenylethyl)-;2-(2-phenylethyl)malonic acid;NSC402048;phenylethylmalonic acid;Propanedioic acid, 2-(2-phenylethyl)-;benzylmethylmalonic acid;2-Phenethylmalonic acid;2-phenylethylmalonic acid;2-Phenethyl-malonic acid;CHEMBL369031;SCHEMBL2291948;DTXSID50190586;ZINC5682547;LABOTEST-BB LT00408946;SBB057495;AKOS005215986;MCULE-5275763163;NSC 402048;NSC-402048;ST51003170

2-(2-phenylethyl)propanedioic acid Basic Attributes

208.21 g/mol

208.07355886 g/mol

402048

DTXSID50190586

Characteristics

74.6 Ų

Safety Information

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:208.21
XLogP3:1.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:208.07355886
Monoisotopic Mass:208.07355886
Topological Polar Surface Area:74.6
Heavy Atom Count:15
Complexity:217
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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