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Name |
Pentane,1,1,5,5-tetramethoxy-2-methyl- |
EINECS | 272-516-6 |
CAS No. | 68860-50-4 | Density | 0.936 g/cm3 |
PSA | 36.92000 | LogP | 1.64050 |
Solubility | N/A | Melting Point |
N/A |
Formula | C10H22O4 | Boiling Point | 235.2 °C at 760 mmHg |
Molecular Weight | 206.28 | Flash Point | 62.2 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
Pentane,4-(dimethoxymethyl)-1,1-dimethoxy- (9CI);1,1,5,5-Tetramethoxy-2-methylpentane;4-(Dimethoxymethyl)-1,1-dimethoxypentane; |
The Pentane,1,1,5,5-tetramethoxy-2-methyl-, with the CAS registry number 68860-50-4, is also known as 4-(Dimethoxymethyl)-1,1-dimethoxypentane. This chemical's molecular formula is C10H22O4 and molecular weight is 206.28. What's more, its systematic name is 1,1,5,5-Tetramethoxy-2-methylpentane and its EINECS number is 272-516-6.
Physical properties of Pentane,1,1,5,5-tetramethoxy-2-methyl- are: (1)ACD/LogP: 0.29; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.29; (4)ACD/LogD (pH 7.4): 0.29; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 34.15; (8)ACD/KOC (pH 7.4): 34.15; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 36.92 Å2; (13)Index of Refraction: 1.415; (14)Molar Refractivity: 55.23 cm3; (15)Molar Volume: 220.1 cm3; (16)Polarizability: 21.89×10-24 cm3; (17)Surface Tension: 26.7 dyne/cm; (18)Density: 0.936 g/cm3; (19)Flash Point: 62.2 °C; (20)Enthalpy of Vaporization: 45.28 kJ/mol; (21)Boiling Point: 235.2 °C at 760 mmHg; (22)Vapour Pressure: 0.0776 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC(CCC(OC)OC)C(OC)OC
(2)InChI: InChI=1S/C10H22O4/c1-8(10(13-4)14-5)6-7-9(11-2)12-3/h8-10H,6-7H2,1-5H3
(3)InChIKey: JBEZZHPFGNHYEV-UHFFFAOYSA-N