Basic Information | Post buying leads | Suppliers |
Name |
Benzeneacetic acid,4-(methoxymethyl)- |
EINECS | N/A |
CAS No. | 343880-24-0 | Density | 1.154 g/cm3 |
PSA | 46.53000 | LogP | 1.46010 |
Solubility | N/A | Melting Point |
N/A |
Formula | C10H12O3 | Boiling Point | 300.1 °C at 760 mmHg |
Molecular Weight | 180.2005 | Flash Point | 117 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
[4-(Methoxymethyl)phenyl]aceticacid; |
The Benzeneacetic acid, 4-(methoxymethyl)-, with the CAS registry number 343880-24-0, is also known as [4-(Methoxymethyl)phenyl]acetic acid. This chemical's molecular formula is C10H12O3 and molecular weight is 180.2005. What's more, its systematic name is 2-(4-(Methoxymethyl)phenyl)acetic acid. In addition, it must be stored in airtight containers and placed in a dry, ventilated, cool place. Meanwhile, it should be kept away from oxidant.
Physical properties about Benzeneacetic acid, 4-(methoxymethyl)- are: (1)ACD/LogP: 1.24; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.01; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 6.6; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 46.53 Å2; (12)Index of Refraction: 1.536; (13)Molar Refractivity: 48.66 cm3; (14)Molar Volume: 156 cm3; (15)Polarizability: 19.29×10-24 cm3; (16)Surface Tension: 44 dyne/cm; (17)Density: 1.154 g/cm3; (18)Flash Point: 117 °C; (19)Enthalpy of Vaporization: 57.03 kJ/mol; (20)Boiling Point: 300.1 °C at 760 mmHg; (21)Vapour Pressure: 0.000511 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: COCc1ccc(cc1)CC(O)=O
(2) InChI: InChI=1/C10H12O3/c1-13-7-9-4-2-8(3-5-9)6-10(11)12/h2-5H,6-7H2,1H3,(H,11,12)
(3) InChIKey: UBICBXUVKYZJTD-UHFFFAOYAL