ChemicalBook--->CAS DataBase List--->536-66-3

536-66-3

536-66-3 Structure

536-66-3 Structure
IdentificationMore
[Name]

4-Isopropylbenzoic acid
[CAS]

536-66-3
[Synonyms]

4-ISOPROPYLBENZOIC ACID
CUMIC ACID
CUMINIC ACID
P-ISO-PROPYLBENZOIC ACID
RARECHEM AL BO 0601
4-(1-Methylethyl)benzoic acid
4-(1-methylethyl)-benzoicaci
4-(1-methylethyl)benzoicacid
Benzoic acid, p-isopropyl-
p-isopropyl-benzoicaci
4-isopropyl benzioc acid
4-Lsopropylbenzoic acid
P-ISOPROPYLBENZOIC ACID CRYSTALLINE
4-Isopropyl Benzoic acid (Cuminic Acid)
4-Isopropylbenzoic acid, 98+%
Benzoicacid,4-(1-methylet
Cumic acid, Cuminic acid
p-Cuminic acid
[EINECS(EC#)]

208-642-5
[Molecular Formula]

C10H12O2
[MDL Number]

MFCD00002564
[Molecular Weight]

164.2
[MOL File]

536-66-3.mol
Chemical PropertiesBack Directory
[Appearance]

white crystalline powder
[Melting point ]

117-120 °C (lit.)
[mp ]

117-120 °C(lit.)
[Boiling point ]

271.8°C
[density ]

d4 1.162
[refractive index ]

1.5198 (estimate)
[storage temp. ]

Inert atmosphere,Room Temperature
[solubility ]

alcohol: soluble(lit.)
[form ]

Crystalline Powder
[pka]

4.35±0.10(Predicted)
[color ]

White
[Water Solubility ]

sparingly soluble
[Merck ]

14,2618
[InChIKey]

CKMXAIVXVKGGFM-UHFFFAOYSA-N
[CAS DataBase Reference]

536-66-3(CAS DataBase Reference)
[NIST Chemistry Reference]

Benzoic acid, 4-(1-methylethyl)-(536-66-3)
[EPA Substance Registry System]

536-66-3(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

Xi,Xn
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
[Safety Statements ]

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

3
[RTECS ]

DH3850500
[TSCA ]

Yes
[HS Code ]

29163990
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

4-Isopropylbenzoic acid(536-66-3).msds
Hazard InformationBack Directory
[Chemical Properties]

white crystalline powder
[Uses]

4-Isopropylbenzoic acid (cuminic acid) was used in the synthesis of three new triorganotin carboxylates bearing methyl, butyl and phenyl substituents at tin, respectively. The products were fully characterized by spectroscopic and thermal techniques, with regard to the coordination number of tin atom, in solution and in the solid state.
[Definition]

ChEBI: A cumic acid that consists of benzoic acid substituted by an isopropyl group at position 4.
Spectrum DetailBack Directory
[Spectrum Detail]

4-Isopropylbenzoic acid(536-66-3)1HNMR
4-Isopropylbenzoic acid(536-66-3)13CNMR
4-Isopropylbenzoic acid(536-66-3)IR1
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

4-Isopropylbenzoic acid, 98+%(536-66-3)
[Alfa Aesar]

4-Isopropylbenzoic acid, 99%(536-66-3)
[Sigma Aldrich]

536-66-3(sigmaaldrich)
[TCI AMERICA]

Cuminic Acid,>98.0%(GC)(T)(536-66-3)
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