Products Categories
| CAS No.: | 66576-71-4 |
|---|---|
| Name: | FEMA 3699 |
| Article Data: | 2 |
| Molecular Structure: | |
|
|
|
| Formula: | C8H16O2 |
| Molecular Weight: | 144.214 |
| Synonyms: | 2-Methylbutanoicacid 1-methylethyl ester;Isopropyl 2-methylbutyrate;Propan-2-yl 2-methylbutanoate; |
| EINECS: | 266-411-4 |
| Density: | 0.874 g/cm3 |
| Boiling Point: | 144.4 °C at 760 mmHg |
| Flash Point: | 34.7 °C |
| Solubility: | 691mg/L at 20℃ |
| Risk Codes: | 10 |
| Safety: | 24/25 |
| Transport Information: | UN 3272 3/PG 3 |
| PSA: | 26.30000 |
| LogP: | 1.98410 |
- 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:23 Page 1 of 1 1
What can I do for you?
Get Best Price
Specification
The Butanoic acid,2-methyl-, 1-methylethyl ester, with the CAS registry number 66576-71-4, is also known as 2-Methylbutanoicacid 1-methylethyl ester. It belongs to the product categories of Alphabetical Listings; Flavors and Fragrances; I-L. Its EINECS number is 266-411-4. This chemical's molecular formula is C8H16O2 and molecular weight is 144.21. What's more, its systematic name is propan-2-yl 2-methylbutanoate.
Physical properties of Butanoic acid,2-methyl-, 1-methylethyl ester are: (1)ACD/LogP: 2.47; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.47; (4)ACD/LogD (pH 7.4): 2.47; (5)ACD/BCF (pH 5.5): 44.06; (6)ACD/BCF (pH 7.4): 44.06; (7)ACD/KOC (pH 5.5): 522.89; (8)ACD/KOC (pH 7.4): 522.89; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 26.3 Å2; (13)Index of Refraction: 1.409; (14)Molar Refractivity: 40.8 cm3; (15)Molar Volume: 164.8 cm3; (16)Polarizability: 16.17×10-24cm3; (17)Surface Tension: 25.3 dyne/cm; (18)Density: 0.874 g/cm3; (19)Flash Point: 34.7 °C; (20)Enthalpy of Vaporization: 38.15 kJ/mol; (21)Boiling Point: 144.4 °C at 760 mmHg; (22)Vapour Pressure: 5.1 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC(C)C)C(CC)C
(2)Std. InChI: InChI=1S/C8H16O2/c1-5-7(4)8(9)10-6(2)3/h6-7H,5H2,1-4H3
(3)Std. InChIKey: DIRDKDDFAMNBNY-UHFFFAOYSA-N