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Benzeneacetic acid,3,5-bis(phenylmethoxy)-

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Name

Benzeneacetic acid,3,5-bis(phenylmethoxy)-

EINECS N/A
CAS No. 2732-96-9 Density 1.162 g/cm3
PSA 44.76000 LogP 4.63120
Solubility N/A Melting Point 67-70 °C
Formula C23H22O4 Boiling Point 510.6 °C at 760 mmHg
Molecular Weight 348.398 Flash Point 222.3 °C
Transport Information N/A Appearance N/A
Safety 24/25 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 2732-96-9 (METHYL 3,5-DIBENZYLOXYBENZOATE) Hazard Symbols N/A
Synonyms

Acetic acid,[3,5-bis(benzyloxy)phenyl]- (7CI,8CI);3,5-Bis(benzyloxy)phenylacetic acid;3,5-Dibenzyloxyphenylacetic acid;

Article Data 10

Benzeneacetic acid,3,5-bis(phenylmethoxy)- Specification

The Benzeneacetic acid,3,5-bis(phenylmethoxy)- is an organic compound with the formula C23H22O4. The systematic name of this chemical is methyl [3,5-bis(benzyloxy)phenyl]acetate. With the CAS registry number 2732-96-9, it is also named as benzeneacetic acid, 3,5-bis(phenylmethoxy)-, methyl ester.

Physical properties about Benzeneacetic acid,3,5-bis(phenylmethoxy)- are: (1)ACD/LogP: 4.99; (2)ACD/LogD (pH 5.5): 4.99; (3)ACD/LogD (pH 7.4): 4.99; (4)ACD/BCF (pH 5.5): 3636.26; (5)ACD/BCF (pH 7.4): 3636.26; (6)ACD/KOC (pH 5.5): 12311.49; (7)ACD/KOC (pH 7.4): 12311.49; (8)#H bond acceptors: 4; (9)#Freely Rotating Bonds: 9; (10)Polar Surface Area: 44.76 Å2; (11)Index of Refraction: 1.585; (12)Molar Refractivity: 104.54 cm3; (13)Molar Volume: 311.6 cm3; (14)Polarizability: 41.44×10-24cm3; (15)Surface Tension: 44.7 dyne/cm; (16)Density: 1.162 g/cm3; (17)Flash Point: 222.3 °C; (18)Enthalpy of Vaporization: 78.14 kJ/mol; (19)Boiling Point: 510.6 °C at 760 mmHg; (20)Vapour Pressure: 1.53E-10 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, avoid contact with skin and eyes.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC)Cc3cc(OCc1ccccc1)cc(OCc2ccccc2)c3
(2)InChI: InChI=1/C23H22O4/c1-25-23(24)14-20-12-21(26-16-18-8-4-2-5-9-18)15-22(13-20)27-17-19-10-6-3-7-11-19/h2-13,15H,14,16-17H2,1H3
(3)InChIKey: XHCUURXWHWSIPU-UHFFFAOYAF
(4)Std. InChI: InChI=1S/C23H22O4/c1-25-23(24)14-20-12-21(26-16-18-8-4-2-5-9-18)15-22(13-20)27-17-19-10-6-3-7-11-19/h2-13,15H,14,16-17H2,1H3
(5)Std. InChIKey: XHCUURXWHWSIPU-UHFFFAOYSA-N

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