Basic Information | Post buying leads | Suppliers |
Name |
Benzoic acid,4-(1,4-dioxaspiro[4.5]dec-8-yl)- |
EINECS | N/A |
CAS No. | 163260-73-9 | Density | 1.26 g/cm3 |
PSA | 55.76000 | LogP | 2.78550 |
Solubility | N/A | Melting Point |
N/A |
Formula | C15H18O4 | Boiling Point | 436.1 °C at 760 mmHg |
Molecular Weight | 262.3 | Flash Point | 164 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
4-(1,4-Dioxaspiro[4.5]decan-8-yl)benzoicacid; |
The Benzoic acid,4-(1,4-dioxaspiro[4.5]dec-8-yl)- has the CAS registry number 163260-73-9. This chemical's molecular formula is C15H18O4 and molecular weight is 262.3. What's more, its systematic name is 4-(1,4-Dioxaspiro[4.5]decan-8-yl)benzoic acid.
Physical properties of Benzoic acid,4-(1,4-dioxaspiro[4.5]dec-8-yl)- are: (1)ACD/LogP: 2.60; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 4; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 55.76 Å2; (7)Index of Refraction: 1.583; (8)Molar Refractivity: 69.45 cm3; (9)Molar Volume: 207.7 cm3; (10)Polarizability: 27.53×10-24 cm3; (11)Surface Tension: 53 dyne/cm; (12)Density: 1.26 g/cm3; (13)Flash Point: 164 °C; (14)Enthalpy of Vaporization: 73 kJ/mol; (15)Boiling Point: 436.1 °C at 760 mmHg; (16)Vapour Pressure: 2.23E-08 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: OC(=O)c1ccc(cc1)C2CCC3(CC2)OCCO3
(2)InChI: InChI=1S/C15H18O4/c16-14(17)13-3-1-11(2-4-13)12-5-7-15(8-6-12)18-9-10-19-15/h1-4,12H,5-10H2,(H,16,17)
(3)InChIKey: RXTBZHWAFRMKNN-UHFFFAOYSA-N