Products Categories
CAS No.: | 374-99-2 |
---|---|
Name: | 2,2,3,3,4,4,4-HEPTAFLUOROBUTYLAMINE |
Article Data: | 8 |
Molecular Structure: | |
Formula: | C4H4F7N |
Molecular Weight: | 199.071 |
Synonyms: | Butylamine,2,2,3,3,4,4,4-heptafluoro- (6CI,7CI,8CI);2,2,3,3,4,4,4-Heptafluorobutylamine; |
EINECS: | 206-780-0 |
Density: | 1.458 g/cm3 |
Boiling Point: | 66.3 °C at 760 mmHg |
Flash Point: | 5.2 °C |
Solubility: | Soluble in water. |
Appearance: | clear colorless liquid |
Hazard Symbols: | C,Xi |
Risk Codes: | 34 |
Safety: | 45-36/37/39-26 |
PSA: | 26.02000 |
LogP: | 2.47830 |
What can I do for you?
Get Best Price
The 1-Butanamine,2,2,3,3,4,4,4-heptafluoro-, with the CAS registry number 374-99-2, is also known as Butylamine, 2,2,3,3,4,4,4-heptafluoro-. Its EINECS registry number is 206-780-0. This chemical's molecular formula is C4H4F7N and molecular weight is 199.07. What's more, both its IUPAC name and systematic name are the same which is called 2,2,3,3,4,4,4-Heptafluorobutan-1-amine.
Physical properties about 1-Butanamine,2,2,3,3,4,4,4-heptafluoro- are: (1)ACD/LogP: 2.41; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.87; (4)ACD/LogD (pH 7.4): 2.4; (5)ACD/BCF (pH 5.5): 11.65; (6)ACD/BCF (pH 7.4): 38.68; (7)ACD/KOC (pH 5.5): 142.26; (8)ACD/KOC (pH 7.4): 472.27; (9)#H bond acceptors: 1; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 3.24 Å2; (13)Index of Refraction: 1.295; (14)Molar Refractivity: 25.15 cm3; (15)Molar Volume: 136.5 cm3; (16)Surface Tension: 15.7 dyne/cm; (17)Density: 1.458 g/cm3; (18)Flash Point: 5.2 °C; (19)Enthalpy of Vaporization: 30.82 kJ/mol; (20)Boiling Point: 66.3 °C at 760 mmHg; (21)Vapour Pressure: 153 mmHg at 25 °C.
When you are dealing with this chemical, you should be very careful. This chemical may destroy living tissue on contact and may cause burns. Therefore, you should wear suitable protective clothing, gloves and eye/face protection. In case of contacting with eyes, you should rinse immediately with plenty of water and seek medical advice. And in case of accident or if you feel unwell seek medical advice immediately.
You can still convert the following datas into molecular structure:
(1) SMILES: FC(F)(C(F)(F)F)C(F)(F)CN
(2) InChI: InChI=1/C4H4F7N/c5-2(6,1-12)3(7,8)4(9,10)11/h1,12H2
(3) InChIKey: WBGBQSRNXPVFDB-UHFFFAOYAZ
The toxicity data is as follows:
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intravenous | 10mg/kg (10mg/kg) | "Fluorine Chemistry, Volume III. Biological Effects of Organic Fluorides," Simons, J.H., ed., New York, Academic Press, Inc., 1963Vol. 3, Pg. 77, 1963. |