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2-Methylbutan-2-Yl Benzoate
[CAS# 6963-55-9]

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CAS#: 6963-55-9
Product: 2-Methylbutan-2-Yl Benzoate
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Identification
Name 2-Methylbutan-2-Yl Benzoate
Synonyms 1,1-Dimethylpropyl Benzoate; Benzoic Acid 1,1-Dimethylpropyl Ester; Benzoic Acid Tert-Amyl Ester
Molecular Structure CAS#: 6963-55-9, 2-Methylbutan-2-Yl Benzoate
Molecular Formula C12H16O2
Molecular Weight 192.26
CAS Registry Number 6963-55-9
SMILES C1=C(C(OC(CC)(C)C)=O)C=CC=C1
InChI 1S/C12H16O2/c1-4-12(2,3)14-11(13)10-8-6-5-7-9-10/h5-9H,4H2,1-3H3
InChIKey VAQNNXXADMWCTA-UHFFFAOYSA-N
Properties
Density 0.994g/cm3 (Cal.)
Boiling point 251.254°C at 760 mmHg (Cal.)
Flash point 110.402°C (Cal.)
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