3-Phenylbutyric acid
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For more informationemailINFO@PARCHEM.COM
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Product Description
Product
3-Phenylbutyric acid
CAS
4593-90-2
Formula
C10H12O2;
Synonym
ß-Phenyl-n-butyric acid; Benzenepropanoic acid, ß-methyl-; 3-Phenylbutanoic acid;RARECHEM AL BE 0683; BETA-PHENYL-N-BUTYRIC ACID; (+/-)-BETA-METHYLHYDROCINNAMIC ACID; (+/-)-3-PHENYLBUTYRIC ACID; 3-PHENYLBUTYRIC ACID; 3-Phenylbutanoic acid; Benzenepropanoic acid, beta-methyl-; 3-PHENYLBUTYRIC ACID 99%;
<li id='ds2'><div>3-Phenylbutyric acid;
<li id='ds3'><div>AI3-11112;
<li id='ds4'><div>EINECS 224-987-4;
<li id='ds5'><div>NSC 177801;
</ul></div></div><h3>Systematic Names</h3><div class='yui3-g-r'><div class='yui3-u-1-4'><ul>
<li id='ds6'><div>3-Phenylbutyric acid;
<li id='ds7'><div>Benzenepropanoic acid, beta-methyl-;
Typical Product Specifications
Molecular weight
164.20
EINECS
224-987-4
SMILES
c1([C@@H](CC(O)=O)C)ccccc1
InChI
1S/C10H12O2/c1-8(7-10(11)12)9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,11,12)
InChIKey
ZZEWMYILWXCRHZ-UHFFFAOYSA-N
Atmospheric OH Rate Constant
8.25E-12 cm3/molecule-sec
Water solubility
2240 mg/L
Henry's Law Constant
7.79E-08 atm-m3/mole
log P (octanol-water)
2.18
Melting Point
39-37 ° C
Vapor Pressure
1.31E-03 mm Hg
BRN Number
2044322
Melting Point
35-38 °C
Flash Point
77 °F
Boiling Point
170-172 °C20 mm Hg
Density
1.515 g/mL at 25 °C
Class
3-Phenylbutyric acid
For more information call (914) 654-6800or email INFO@PARCHEM.COM
(914) 654-6800
INFO@PARCHEM.COM
For more informationemailINFO@PARCHEM.COM
email
INFO@PARCHEM.COM
Product Description
Product
3-Phenylbutyric acid
CAS
4593-90-2
Formula
C10H12O2;
Synonym
ß-Phenyl-n-butyric acid; Benzenepropanoic acid, ß-methyl-; 3-Phenylbutanoic acid;RARECHEM AL BE 0683; BETA-PHENYL-N-BUTYRIC ACID; (+/-)-BETA-METHYLHYDROCINNAMIC ACID; (+/-)-3-PHENYLBUTYRIC ACID; 3-PHENYLBUTYRIC ACID; 3-Phenylbutanoic acid; Benzenepropanoic acid, beta-methyl-; 3-PHENYLBUTYRIC ACID 99%;
<li id='ds2'><div>3-Phenylbutyric acid;
<li id='ds3'><div>AI3-11112;
<li id='ds4'><div>EINECS 224-987-4;
<li id='ds5'><div>NSC 177801;
</ul></div></div><h3>Systematic Names</h3><div class='yui3-g-r'><div class='yui3-u-1-4'><ul>
<li id='ds6'><div>3-Phenylbutyric acid;
<li id='ds7'><div>Benzenepropanoic acid, beta-methyl-;
Typical Product Specifications
Molecular weight
164.20
EINECS
224-987-4
SMILES
c1([C@@H](CC(O)=O)C)ccccc1
InChI
1S/C10H12O2/c1-8(7-10(11)12)9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,11,12)
InChIKey
ZZEWMYILWXCRHZ-UHFFFAOYSA-N
Atmospheric OH Rate Constant
8.25E-12 cm3/molecule-sec
Water solubility
2240 mg/L
Henry's Law Constant
7.79E-08 atm-m3/mole
log P (octanol-water)
2.18
Melting Point
39-37 ° C
Vapor Pressure
1.31E-03 mm Hg
BRN Number
2044322
Melting Point
35-38 °C
Flash Point
77 °F
Boiling Point
170-172 °C20 mm Hg
Density
1.515 g/mL at 25 °C
Class
