Products Categories
| CAS No.: | 62199-62-6 |
|---|---|
| Name: | 2,2,4,4,6-Pentamethylheptane |
| Molecular Structure: | |
|
|
|
| Formula: | C12H26 |
| Molecular Weight: | 170.338 |
| Synonyms: | Heptane, 2,2,4,4,6-pentamethyl-; |
| EINECS: | 263-451-4 |
| Density: | 0.75 g/cm3 |
| Melting Point: | -50.8°C (estimate) |
| Boiling Point: | 186.6 °C at 760 mmHg |
| Flash Point: | 63.2 °C |
| PSA: | 0.00000 |
| LogP: | 4.49490 |
- 81281-59-67-Benzylideneaminotheophylline
- 82993-81-5D-threo-Ritalinic acid hydrochloride
- 73441-42-6METHYL-5-CHLORO-2,2-DIMETHYLVALERATE
- 68439-39-4Poly(oxy-1,2-ethanediyl), alpha-(2-ethylhexyl)-omega-hydroxy-,
- 852475-26-4MC1568
- 958254-66-51H-Imidazo[4,5-b]pyridine-2-carboxaldehyde, 1-methyl-, hydrochloride
- 99170-93-1N-Methyl-2-oxazolamine
- 717878-06-31-(4-fluorophenyl)-4-nitro-1H-imidazole
- 914458-26-7[5-(2-fluorophenyl)-1-pentyl-1H-pyrrol-3-yl]-1-naphthalenyl-Methanone
- 894852-01-87-BROMO-2,2-DIMETHYL-2H-PYRIDO[3,2-B][1,4]OXAZIN-3(4H)-ONE
- Total:21 Page 1 of 1 1
What can I do for you?
Get Best Price
Specification
The 2,2,4,4,6-Pentamethylheptane, with the CAS registry number 62199-62-6, is also known as Heptane, 2,2,4,4,6-pentamethyl-. Its EINECS registry number is 263-451-4. This chemical's molecular formula is C12H26 and molecular weight is 170.34. What's more, both its IUPAC name and systematic name are the same which is called 2,2,4,4,6-Pentamethylheptane.
Physical properties about 2,2,4,4,6-Pentamethylheptane are: (1)ACD/LogP: 6.22; (2) # of Rule of 5 Violations: 1; (3) ACD/LogD (pH 5.5): 6.22; (4) ACD/LogD (pH 7.4): 6.22; (5) ACD/BCF (pH 5.5): 31206.67; (6) ACD/BCF (pH 7.4): 31206.67; (7) ACD/KOC (pH 5.5): 57354.35; (8) ACD/KOC (pH 7.4): 57354.35; (9) #H bond acceptors: 0; (10) #H bond donors: 0; (11) #Freely Rotating Bonds: 4; (12) Polar Surface Area: 0 Å2; (13) Index of Refraction: 1.42; (14) Molar Refractivity: 57.53 cm3; (15) Molar Volume: 227 cm3; (16) Surface Tension: 22.9 dyne/cm; (17) Density: 0.75 g/cm3; (18) Flash Point: 63.2 °C; (19) Enthalpy of Vaporization: 40.55 kJ/mol; (20) Boiling Point: 186.6 °C at 760 mmHg; (21) Vapour Pressure: 0.906 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: CC(C)(CC(C)C)CC(C)(C)C
(2) InChI: InChI=1/C12H26/c1-10(2)8-12(6,7)9-11(3,4)5/h10H,8-9H2,1-7H3
(3) InChIKey: NOFQKTWPZFUCOO-UHFFFAOYAB