Products Categories
| CAS No.: | 4387-31-9 |
|---|---|
| Name: | 4-CHLORO-3-METHYLBENZONITRILE |
| Article Data: | 3 |
| Cas Database | |
| Molecular Structure: | |
|
|
|
| Formula: | C8H6ClN |
| Molecular Weight: | 151.595 |
| Synonyms: | m-Tolunitrile,4-chloro- (7CI,8CI); |
| Density: | 1.19 g/cm3 |
| Boiling Point: | 243.5 °C at 760 mmHg |
| Flash Point: | 99.9 °C |
| PSA: | 23.79000 |
| LogP: | 2.52008 |
- 4387-32-0Benzonitrile,2-chloro-5-methyl-
- 4387-36-4Benzonitrile, 2-iodo-
- 4388-22-1Benzenesulfonothioicacid, anhydrosulfide
- 4388-97-01,3-Dioxolane-2-methanamine
- 43-89-0ethylbenzoate
- 4389-45-13-Methylanthranilic acid
- 4389-50-8Benzoic acid,2-amino-6-methyl-
- 4390-04-9Nonane,2,2,4,4,6,8,8-heptamethyl-
- 4390-94-76-Methoxy-2-(4-methoxyphenyl)benzo[bithiophene]
- 439108-20-02-Pyrimidinepropanoicacid
- Total:37 Page 1 of 1 1
What can I do for you?
Get Best Price
Specification
The Benzonitrile,4-chloro-3-methyl- with the CAS number 4387-31-9 is also called m-Tolunitrile,4-chloro- (7CI,8CI). The systematic name is 4-chloro-3-methylbenzonitrile. Its molecular formula is C8H6ClN. This chemical belongs to the following product categories: (1)Nitrile; (2)Chlorine Compounds; (3)Nitriles.
The properties of the Benzonitrile,4-chloro-3-methyl- are: (1)ACD/LogP: 2.66; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 0; (6)Polar Surface Area: 23.79 Å2; (7)Index of Refraction: 1.553; (8)Molar Refractivity: 40.77 cm3; (9)Molar Volume: 127.3 cm3; (10)Polarizability: 16.16×10-24cm3; (11)Surface Tension: 44.2 dyne/cm; (12)Enthalpy of Vaporization: 48.05 kJ/mol; (13)Vapour Pressure: 0.0321 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1ccc(C#N)cc1C
(2)InChI: InChI=1/C8H6ClN/c1-6-4-7(5-10)2-3-8(6)9/h2-4H,1H3
(3)InChIKey: SQISNVXBYZWWBC-UHFFFAOYAL