ChemicalBook--->CAS DataBase List--->42287-90-1

42287-90-1

42287-90-1 Structure

42287-90-1 Structure
IdentificationMore
[Name]

3-(3-Bromophenyl)propionic acid
[CAS]

42287-90-1
[Synonyms]

3-(3-BROMOPHENYL)PROPIONIC ACID
BUTTPARK 51\07-25
RARECHEM AL BO 0920
3-(3-Bromophenyl)propanoic acid
[Molecular Formula]

C9H9BrO2
[MDL Number]

MFCD01310792
[Molecular Weight]

229.07
[MOL File]

42287-90-1.mol
Chemical PropertiesBack Directory
[Melting point ]

72-76 °C
[Boiling point ]

336.3±17.0 °C(Predicted)
[density ]

1.531±0.06 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Room Temperature
[form ]

solid
[pka]

4.58±0.10(Predicted)
[color ]

Off-white to light yellow
[Water Solubility ]

Insoluble in water.
[BRN ]

2362753
[InChI]

InChI=1S/C9H9BrO2/c10-8-3-1-2-7(6-8)4-5-9(11)12/h1-3,6H,4-5H2,(H,11,12)
[InChIKey]

DWKWMFSWLCIMKI-UHFFFAOYSA-N
[SMILES]

C1(CCC(O)=O)=CC=CC(Br)=C1
[CAS DataBase Reference]

42287-90-1(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi,Xn
[Risk Statements ]

R34:Causes burns.
R22:Harmful if swallowed.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
[RIDADR ]

3261
[WGK Germany ]

3
[HazardClass ]

IRRITANT
[HS Code ]

29163990
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Hazard InformationBack Directory
[Uses]

It is used in the synthesis and characterization of monoisomeric 1,8,15,22-substituted (A3B and A2B2) phthalocyanines and phthalocyanine-fullerene dyads.
Spectrum DetailBack Directory
[Spectrum Detail]

3-(3-Bromophenyl)propionic acid(42287-90-1)1HNMR
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

3-(3-Bromophenyl)propionic acid, 97%(42287-90-1)
[Sigma Aldrich]

42287-90-1(sigmaaldrich)
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