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Name |
Alkanes, C11-15-iso- |
EINECS | 292-460-6 |
CAS No. | 90622-58-5 | Density | 0.754 g/cm3 |
PSA | 0.00000 | LogP | 4.88500 |
Solubility | N/A | Melting Point |
N/A |
Formula | C13H28 | Boiling Point | 212.5 °C at 760 mmHg |
Molecular Weight | 184.36142 [g/mol] | Flash Point | 79.4 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
Decane, 3,5,7-trimethyl-;3,5,7-Trimethyldecane; |
The CAS register number of Alkanes, C11-15-iso- is 90622-58-5. It also can be called as Decane, 3,5,7-trimethyl- and the IUPAC name about this chemical is 3,5,7-trimethyldecane. The molecular formula about this chemical is C13H28 and the molecular weight is 184.36142 [g/mol].
Physical properties about Alkanes, C11-15-iso- are: (1)ACD/LogP: 7.11; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 7.11; (4)ACD/LogD (pH 7.4): 7.11; (5)ACD/BCF (pH 5.5): 149443.86; (6)ACD/BCF (pH 7.4): 149443.86; (7)ACD/KOC (pH 5.5): 175981.95; (8)ACD/KOC (pH 7.4): 175981.95; (9)#Freely Rotating Bonds: 7; (10)Index of Refraction: 1.422; (11)Molar Refractivity: 62.15 cm3; (12)Molar Volume: 244.2 cm3; (13)Polarizability: 24.63x10-24cm3; (14)Surface Tension: 24.1 dyne/cm; (15)Enthalpy of Vaporization: 43.05 kJ/mol; (16)Boiling Point: 212.5 °C at 760 mmHg; (17)Vapour Pressure: 0.251 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: CCCC(C)CC(C)CC(C)CC
(2)InChI: InChI=1/C13H28/c1-6-8-12(4)10-13(5)9-11(3)7-2/h11-13H,6-10H2,1-5H3
(3)InChIKey: PEYBKVQWVSPNDC-UHFFFAOYAM
(4)Std. InChI: InChI=1S/C13H28/c1-6-8-12(4)10-13(5)9-11(3)7-2/h11-13H,6-10H2,1-5H3
(5)Std. InChIKey: PEYBKVQWVSPNDC-UHFFFAOYSA-N