| Identification | More | [Name]
HEXANENITRILE | [CAS]
628-73-9 | [Synonyms]
1-CYANOPENTANE
Amyl cyanide
CAPROIC NITRILE
CAPRONITRILE
HEXANENITRILE
HEXANOIC ACID NITRILE
HEXANONITRILE
N-AMYL CYANIDE
N-CAPRONITRILE
N-HEXANENITRILE
N-HEXANOIC ACID NITRILE
N-PENTYL CYANIDE
PENTYLCYANIDE
Capronitril
n-Caproic nitrile
Tricapronile | [EINECS(EC#)]
211-052-0 | [Molecular Formula]
C6H11N | [MDL Number]
MFCD00001979 | [Molecular Weight]
97.16 | [MOL File]
628-73-9.mol |
| Chemical Properties | Back Directory | [Melting point ]
−80 °C(lit.) | [Boiling point ]
161-164 °C(lit.) | [density ]
0.809 g/mL at 25 °C(lit.)
| [refractive index ]
n20/D 1.406(lit.)
| [Fp ]
110 °F
| [form ]
clear liquid | [color ]
Colorless to Light yellow | [Dielectric constant]
17.3（25℃） | [InChI]
1S/C6H11N/c1-2-3-4-5-6-7/h2-5H2,1H3 | [InChIKey]
AILKHAQXUAOOFU-UHFFFAOYSA-N | [SMILES]
CCCCCC#N | [LogP]
1.660 | [CAS DataBase Reference]
628-73-9(CAS DataBase Reference) | [EPA Substance Registry System]
Hexanenitrile (628-73-9) |
| Safety Data | Back Directory | [Symbol(GHS) ]
 
GHS02,GHS07 | [Signal word ]
Warning | [Hazard statements ]
H226-H302-H315-H319-H335 | [Precautionary statements ]
P210-P301+P312+P330-P302+P352-P305+P351+P338 | [Hazard Codes ]
Xn | [Risk Statements ]
R10:Flammable.
R22:Harmful if swallowed.
R36/37/38:Irritating to eyes, respiratory system and skin . | [Safety Statements ]
S36/37:Wear suitable protective clothing and gloves . | [RIDADR ]
UN 1993 3/PG 3
| [WGK Germany ]
3
| [RTECS ]
MO3900000
| [TSCA ]
TSCA listed | [HS Code ]
2926.90.5050 | [HazardClass ]
3.2 | [PackingGroup ]
III | [Storage Class]
3 - Flammable liquids | [Hazard Classifications]
Acute Tox. 4 Oral
Eye Irrit. 2
Flam. Liq. 3
Skin Irrit. 2
STOT SE 3 |
| Questions And Answer | Back Directory | [Application]
Acetonitriles belong to the nitrile class of compounds and are important precursor compounds for many products, such as polyamides, pigments and dyes, pharmaceuticals, and agrochemicals. The application of nitrile compounds in the fragrance industry has recently developed rapidly, offering advantages such as long-lasting aroma, stable performance, and non-irritating properties, making them a major class of novel synthetic fragrances. The cyano group in nitrile compounds is easily converted into other functional groups, such as carboxylic acids, amides, aldehydes, and primary amines, and is widely used in the total synthesis research of natural products. |
| Hazard Information | Back Directory | [Chemical Properties]
Colorless liquid. Melting point -80.3°C, boiling point 163.6°C, 47.2°C (1.33 kPa), relative density 0.8051 (20/4°C), refractive index 1.4068, flash point 43°C. Soluble in ethanol and ether, very slightly soluble in water. | [Synthesis Reference(s)]
Canadian Journal of Chemistry, 58, p. 2271, 1980 DOI: 10.1139/v80-365
The Journal of Organic Chemistry, 46, p. 4111, 1981 DOI: 10.1021/jo00334a001 | [Synthesis]
Protected by nitrogen, in a 100 mL three-necked flask equipped with a thermometer, anhydrous acetonitrile (10 mL), dimethylsulfoxide (0.03 mmol, 2.5 mg, 0.01 equiv), n-hexanamide (3 mmol, 345 mg, 1.0 equiv), and triethylamine (1.04 mL, 7.5 mmol, 2.5 equiv | [Purification Methods]
Wash the nitrile twice with half-volumes of conc HCl, then with saturated aqueous NaHCO3, dry over MgSO4, filter and distil it. [Beilstein 2 H 324, 2 I 141, 2 II 286, 2 III 733, 2 IV 930.] |
|
| Company Name: |
Energy Chemical
|
| Telephone: |
400-0056266 |
| Website: |
www.energy-chemical.com |
| Company Name: |
Maya High Purity Chemicals
|
| Telephone: |
+86 (573) 82222445 (0)18006601000 452520369 |
| Website: |
www.chemicalbook.com/ShowSupplierProductsList15221/0_EN.htm |
| Company Name: |
Sigma-Aldrich
|
| Telephone: |
021-61415566 800-8193336 |
| Website: |
https://www.sigmaaldrich.cn |
|