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2215-21-6

2215-21-6 Structure

2215-21-6 Structure
IdentificationMore
[Name]

3,5-DIISOPROPYLSALICYLIC ACID
[CAS]

2215-21-6
[Synonyms]

3,5-DIISOPROPYLSALICYLIC ACID
2-Hydroxy-3,5-diisopropylbenzoic acid
3,5-Diisopropyl-2-hydroxybenzoic acid
3,5-Di-#niso-propyl-2-hydroxybenzoic acid
3,5-DIISOPROPYLSALICYLATE
3,5-DIISOPROPYLSALICYCLICACID
[EINECS(EC#)]

218-677-8
[Molecular Formula]

C13H18O3
[MDL Number]

MFCD00008884
[Molecular Weight]

222.28
[MOL File]

2215-21-6.mol
Chemical PropertiesBack Directory
[Appearance]

beige to grey crystalline powder
[Melting point ]

113-115 °C (lit.)
[Boiling point ]

303.46°C (rough estimate)
[density ]

1.1205 (rough estimate)
[refractive index ]

1.4740 (estimate)
[storage temp. ]

4°C
[solubility ]

Soluble in organic solvents.
[form ]

Solid
[pka]

3.21±0.14(Predicted)
[color ]

White to Off-White
[BRN ]

2505176
[InChI]

1S/C13H18O3/c1-7(2)9-5-10(8(3)4)12(14)11(6-9)13(15)16/h5-8,14H,1-4H3,(H,15,16)
[InChIKey]

XUFUYOGWFZSHGE-UHFFFAOYSA-N
[SMILES]

CC(C)c1cc(C(C)C)c(O)c(c1)C(O)=O
[CAS DataBase Reference]

2215-21-6(CAS DataBase Reference)
[EPA Substance Registry System]

Benzoic acid, 2-hydroxy-3,5-bis(1-methylethyl)- (2215-21-6)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37:Irritating to eyes and respiratory system .
[Safety Statements ]

S22:Do not breathe dust .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S37/39:Wear suitable gloves and eye/face protection .
[WGK Germany ]

3
[TSCA ]

Yes
[HS Code ]

29182900
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Chemical Properties]

beige to grey crystalline powder
[Uses]

3,5-Diisopropyl-2-hydroxybenzoic acid was used as starting reagent in the synthesis of Zn(II) and Cd(II) carboxylate complexes.
[Uses]

3,5-Diisopropylsalicylic acid is used to prepare 2,4-Diisopropyl-phenol at 200°C. It is also used as a starting reagent in the synthesis of Zn(II) and Cd(II) carboxylate complexes. It plays the role of OH-inactivating ligand in its complexes with copper(II)2.
[General Description]

3,5-Diisopropyl-2-hydroxybenzoic acid plays the role of OH-inactivating ligand in its complexes with copper(II).
Spectrum DetailBack Directory
[Spectrum Detail]

3,5-DIISOPROPYLSALICYLIC ACID(2215-21-6)MS
3,5-DIISOPROPYLSALICYLIC ACID(2215-21-6)1HNMR
3,5-DIISOPROPYLSALICYLIC ACID(2215-21-6)13CNMR
3,5-DIISOPROPYLSALICYLIC ACID(2215-21-6)IR1
3,5-DIISOPROPYLSALICYLIC ACID(2215-21-6)IR2
3,5-DIISOPROPYLSALICYLIC ACID(2215-21-6)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

3,5-Diisopropylsalicylic acid, 98%(2215-21-6)
[Alfa Aesar]

3,5-Diisopropylsalicylic acid, 98%(2215-21-6)
[Sigma Aldrich]

2215-21-6(sigmaaldrich)
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