Welcome to LookChem.com Sign In|Join Free
  • or
Home > Products >  > 

Butanoic acid,2-methyl-, phenylmethyl ester

Related Products

Hot Products

Name

Butanoic acid,2-methyl-, phenylmethyl ester

EINECS 260-169-3
CAS No. 56423-40-6 Density 1 g/cm3
PSA 26.30000 LogP 2.77590
Solubility N/A Melting Point N/A
Formula C12H16O2 Boiling Point 254 °C at 760 mmHg
Molecular Weight 192.258 Flash Point 98.9 °C
Transport Information N/A Appearance LIQUID
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 56423-40-6 (BENZYL-2-METHYLBUTYRATE) Hazard Symbols N/A
Synonyms

Benzyl2-methylbutyrate;

Article Data 6

Butanoic acid,2-methyl-, phenylmethyl ester Specification

The Butanoic acid,2-methyl-, phenylmethyl ester, with CAS registry number 56423-40-6, has the systematic name of benzyl 2-methylbutanoate. Besides this, it is also called 2-methyl-butanoicaciphenylmethylester. And the chemical formula of this chemical is C12H16O2. What's more, its EINECS is 260-169-3.

Physical properties of Butanoic acid,2-methyl-, phenylmethyl ester: (1)ACD/LogP: 3.34; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.34; (4)ACD/LogD (pH 7.4): 3.34; (5)ACD/BCF (pH 5.5): 203.09; (6)ACD/BCF (pH 7.4): 203.09; (7)ACD/KOC (pH 5.5): 1561.17; (8)ACD/KOC (pH 7.4): 1561.17; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 26.3 Å2; (13)Index of Refraction: 1.495; (14)Molar Refractivity: 56.06 cm3; (15)Molar Volume: 192.1 cm3; (16)Polarizability: 22.22×10-24cm3; (17)Surface Tension: 34.3 dyne/cm; (18)Density: 1 g/cm3; (19)Flash Point: 98.9 °C; (20)Enthalpy of Vaporization: 49.14 kJ/mol; (21)Boiling Point: 254 °C at 760 mmHg; (22)Vapour Pressure: 0.0177 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCc1ccccc1)C(C)CC
(2)InChI: InChI=1/C12H16O2/c1-3-10(2)12(13)14-9-11-7-5-4-6-8-11/h4-8,10H,3,9H2,1-2H3
(3)InChIKey: PTKDIBUNVYIPOD-UHFFFAOYAL
(4)Std. InChI: InChI=1S/C12H16O2/c1-3-10(2)12(13)14-9-11-7-5-4-6-8-11/h4-8,10H,3,9H2,1-2H3
(5)Std. InChIKey: PTKDIBUNVYIPOD-UHFFFAOYSA-N

Post a RFQ

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

1

What can I do for you?
Get Best Price

Get Best Price for 56423-40-6