Aceticacid, 2-[2-(phenylmethyl)phenoxy]- supplier

Name
(2-BENZYL-PHENOXY)-ACETIC ACID
EINECS
CAS No. 25141-45-1
Article Data1
CAS DataBase
Density 1.187 g/cm³
Solubility
Melting Point
Formula C₁₅H₁₄O₃
Boiling Point 393.5 °C at 760 mmHg
Molecular Weight 242.274
Flash Point 147.2 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Aceticacid, [(a-phenyl-o-tolyl)oxy]- (7CI,8CI);Aceticacid, [2-(phenylmethyl)phenoxy]- (9CI);(2-Benzylphenoxy)acetic acid;[(2-Benzylphenyl)oxy]acetic acid;2-[2-Benzylphenoxy]acetic acid;Acetic acid, 2-[2-(phenylmethyl)phenoxy]-;ZINC02390401;AC1M06JB;CID1991435;
PSA 46.53000
LogP 2.74080

Aceticacid, 2-[2-(phenylmethyl)phenoxy]- Specification

The Aceticacid, 2-[2-(phenylmethyl)phenoxy]- with CAS registry number of 25141-45-1 is also known as Aceticacid, [(a-phenyl-o-tolyl)oxy]- (7CI,8CI). The IUPAC name is 2-(2-Benzylphenoxy)acetate. In addition, the formula is C₁₅H₁₄O₃ and the molecular weight is 242.27.

Physical properties about Aceticacid, 2-[2-(phenylmethyl)phenoxy]- are: (1)ACD/LogP: 3.33; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.06; (4)ACD/BCF (pH 5.5): 1.06; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 8.2; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 5; (11)Polar Surface Area: 35.53Å²; (12)Index of Refraction: 1.585; (13)Molar Refractivity: 68.44 cm³; (14)Molar Volume: 203.9 cm³; (15)Polarizability: 27.13×10^-24cm³; (16)Surface Tension: 47.8 dyne/cm; (17)Density: 1.187 g/cm³; (18)Flash Point: 147.2 °C; (19)Enthalpy of Vaporization: 67.85 kJ/mol; (20)Boiling Point: 393.5 °C at 760 mmHg; (21)Vapour Pressure: 6.76E-07 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
1. SMILES: O=C(O)COc1ccccc1Cc2ccccc2
2. InChI: InChI=1/C15H14O3/c16-15(17)11-18-14-9-5-4-8-13(14)10-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,16,17)
3. InChIKey: FNKKMCAPBFWQTQ-UHFFFAOYAX
4. Std. InChI: InChI=1S/C15H14O3/c16-15(17)11-18-14-9-5-4-8-13(14)10-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,16,17)
5. Std. InChIKey: FNKKMCAPBFWQTQ-UHFFFAOYSA-N

Product Name

(2-BENZYL-PHENOXY)-ACETIC ACID

Aceticacid, 2-[2-(phenylmethyl)phenoxy]- Specification

Related Products

Hot Products