4-Tert-Butylphenylacetic Acid
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Product Description
Product
4-Tert-Butylphenylacetic Acid
CAS
32857-63-9
Formula
C12H16O2
Typical Product Specifications
Molecular weight
192.25
EINECS
251-264-0
SMILES
O=C(O)Cc1ccc(cc1)C(C)(C)C
InChI
RUAYXHSDAMWEDR-UHFFFAOYSA-N
InChIKey
1S/C12H16O2/c1-12(2,3)10-6-4-9(5-7-10)8-11(13)14/h4-7H,8H2,1-3H3,(H,13,14)
Atmospheric OH Rate Constant
6.15E-12 cm3/molecule-sec
Vapor Pressure
2.39E-04 mm Hg
log P (octanol-water)
2.98
Henry's Law Constant
1.14E-07 atm-m3/mole
Water solubility
339 mg/L
pKa Dissociation Constant
4.42
Melting Point
77-78°C
Class
4-Tert-Butylphenylacetic Acid
Product Description
Product
4-Tert-Butylphenylacetic Acid
CAS
32857-63-9
Formula
C12H16O2
Typical Product Specifications
Molecular weight
192.25
EINECS
251-264-0
SMILES
O=C(O)Cc1ccc(cc1)C(C)(C)C
InChI
RUAYXHSDAMWEDR-UHFFFAOYSA-N
InChIKey
1S/C12H16O2/c1-12(2,3)10-6-4-9(5-7-10)8-11(13)14/h4-7H,8H2,1-3H3,(H,13,14)
Atmospheric OH Rate Constant
6.15E-12 cm3/molecule-sec
Vapor Pressure
2.39E-04 mm Hg
log P (octanol-water)
2.98
Henry's Law Constant
1.14E-07 atm-m3/mole
Water solubility
339 mg/L
pKa Dissociation Constant
4.42
Melting Point
77-78°C
Class
