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tert-Butyl hydrogen phthalate, 97%, Thermo Scientific Chemicals

Catalog No. AAL0853414
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It finds its application in the resolution and reactions of tertiary alcohols : 2-phenylbutan-2-ol and 3-methylhexan-3-ol.

This Thermo Scientific Chemicals brand product was originally part of the Alfa Aesar product portfolio. Some documentation and label information may refer to the legacy brand. The original Alfa Aesar product / item code or SKU reference has not changed as a part of the brand transition to Thermo Scientific Chemicals.

Applications
It finds its application in the resolution and reactions of tertiary alcohols : 2-phenylbutan-2-ol and 3-methylhexan-3-ol.

Solubility
Insoluble in water.

Notes
Store away from oxidizing agents. Keep the container tightly closed and place it in a cool, dry and well ventilated condition.

Chemical Identifiers

CAS

33693-84-4

Molecular Formula

C12H14O4

Molecular Weight (g/mol)

222.24

MDL Number

MFCD00043711

InChI Key

PBUQZKXKYSAJDO-UHFFFAOYSA-N

Synonym

tert-butyl hydrogen phthalate, 2-tert-butoxycarbonyl benzoic acid, unii-8390xkx0sq, 2-tert-butyl oxycarbonyl benzoic acid, t-monobutyl phthalate, t-butyl hydrogen phthalate, acmc-1ad5b, dsstox_cid_27150, dsstox_rid_82154, dsstox_gsid_47150

PubChem CID

134976

IUPAC Name

2-[(2-methylpropan-2-yl)oxycarbonyl]benzoic acid

SMILES

CC(C)(C)OC(=O)C1=CC=CC=C1C(=O)O

Specifications

Melting Point

84°C to 88°C

Quantity

25 g

Beilstein

2263386

Solubility Information

Insoluble in water.

Formula Weight

222.24

Percent Purity

97%

Chemical Name or Material

tert-Butyl hydrogen phthalate

Hazard Category

H315-H319-H335

Hazard Statement

GHS H Statement
H315-H319-H335
Causes skin irritation.
Causes serious eye irritation.
May cause respiratory irritation.

Precautionary Statement

P261-P264b-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P332+P313-P362-P501c

TSCA

No

Recommended Storage

Ambient temperatures
SDS

RUO – Research Use Only

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