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940-31-8

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940-31-8 Structure

940-31-8 Structure
IdentificationMore
[Name]

2-Phenoxypropionic acid
[CAS]

940-31-8
[Synonyms]

2-PHENOXYPROPANOIC ACID
AKOS BBB/241
ALPHA-METHYLPHENOXYACETIC ACID
ALPHA-PHENOXYPROPIONIC ACID
DL-2-PHENOXYPROPIONIC ACID
2-phenoxy-propanoicaci
2-phenoxy-propionicaci
Acide phenoxy-2-propionique
acidephenoxy-2-propionique
Propionic acid, 2-phenoxy-
(+/-)-2-PHENOXYPROPIONIC ACID, 98+%
DL-2-Phenoxypropionic acid, 98+ %
2-Phenoxypropionsure
a-Phenoxypropionic acid
Propanoic acid, 2-phenoxy-
[EINECS(EC#)]

213-370-5
[Molecular Formula]

C9H10O3
[MDL Number]

MFCD00002643
[Molecular Weight]

166.17
[MOL File]

940-31-8.mol
Chemical PropertiesBack Directory
[Appearance]

white to pale yellow to beige powder
[Melting point ]

112-115 °C (lit.)
[Boiling point ]

265 °C (lit.)
[density ]

1.1708 (rough estimate)
[refractive index ]

1.5500 (estimate)
[Fp ]

265°C
[storage temp. ]

Store at room temperature
[form ]

powder to crystal
[pka]

3.22±0.10(Predicted)
[color ]

White to Almost white
[BRN ]

3198799
[InChI]

InChI=1S/C9H10O3/c1-7(9(10)11)12-8-5-3-2-4-6-8/h2-7H,1H3,(H,10,11)
[InChIKey]

SXERGJJQSKIUIC-UHFFFAOYSA-N
[SMILES]

C(O)(=O)C(OC1=CC=CC=C1)C
[CAS DataBase Reference]

940-31-8(CAS DataBase Reference)
[NIST Chemistry Reference]

Propanoic acid, 2-phenoxy-(940-31-8)
[EPA Substance Registry System]

Propanoic acid, 2-phenoxy- (940-31-8)
Safety DataBack Directory
[Hazard Codes ]

Xi,C
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
R34:Causes burns.
[Safety Statements ]

S24/25:Avoid contact with skin and eyes .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S27:Take off immediately all contaminated clothing .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
[WGK Germany ]

1
[RTECS ]

UF6515000
[TSCA ]

TSCA listed
[HazardClass ]

IRRITANT
[HS Code ]

29189900
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Tetrahydrofuran-->Phenol-->Hexamethylphosphoramide-->2-Bromopropionic acid
[Preparation Products]

6-Acetamidochroman-4-one-->2-Phenoxypropionyl chloride
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

2-Phenoxypropionic acid(940-31-8).msds
Hazard InformationBack Directory
[Chemical Properties]

white to pale yellow to beige powder
[Uses]

2-Phenoxypropionic Acid is used in organic chemistry reduction reactions. Used in the synthesis of PPAR (peroxisome proliferator-activated receptor (PPAR) ligands.
[Definition]

ChEBI: 2-Phenoxypropionic acid is an aromatic ether and a carboxylic acid.
[Synthesis Reference(s)]

The Journal of Organic Chemistry, 43, p. 772, 1978 DOI: 10.1021/jo00398a070
[General Description]

Solvent-induced invesrsion of enantioselectivity during esterification of 2-phenoxypropionic acid catalyzed by Candida cylindracea lipase has been investigated. Derivatives of 2-phenoxypropionic acid are potential herbicides.
[Purification Methods]

Crystallise the acid from water. [Beilstein 6 H 163, 6 II 158, 6 III 614.]
Spectrum DetailBack Directory
[Spectrum Detail]

2-Phenoxypropionic acid(940-31-8)MS
2-Phenoxypropionic acid(940-31-8)1HNMR
2-Phenoxypropionic acid(940-31-8)13CNMR
2-Phenoxypropionic acid(940-31-8)IR1
2-Phenoxypropionic acid(940-31-8)IR2
2-Phenoxypropionic acid(940-31-8)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

DL-2-Phenoxypropionic acid, 98+ %(940-31-8)
[Alfa Aesar]

2-Phenoxypropionic acid, 98%(940-31-8)
[Sigma Aldrich]

940-31-8(sigmaaldrich)
[TCI AMERICA]

2-Phenoxypropionic Acid,>98.0%(GC)(940-31-8)
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