4-Amino-3,5-dimethylbenzonitrile supplier

Name
4-AMINO-3,5-DIMETHYL-BENZONITRILE
EINECS
CAS No. 74896-24-5
Article Data11
CAS DataBase
Density 1.07 g/cm³
Solubility
Melting Point 106.0-107.5 °C
Formula C₉H₁₀N₂
Boiling Point 322.2 °C at 760 mmHg
Molecular Weight 146.192
Flash Point 148.7 °C
Transport Information 3439
Appearance
Safety 26-36/37/39
Risk Codes 20/21/22-36/37/38
Molecular Structure
Hazard Symbols Xn
Synonyms 4-Amino-3,5-dimethylbenzonitrile;NSC 128902;
PSA 49.81000
LogP 2.33848

4-Amino-3,5-dimethylbenzonitrile Specification

This chemical is called 4-Amino-3,5-dimethylbenzonitrile, and it can also be named as Benzonitrile, 4-amino-3,5-dimethyl-. With the molecular formula of C₉H₁₀N₂, its molecular weight is 146.19. The CAS registry number of this chemical is 74896-24-5.

Other characteristics of the 4-Amino-3,5-dimethylbenzonitrile can be summarised as followings: (1)ACD/LogP: 1.99; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 27.03 Å²; (7)Index of Refraction: 1.565; (8)Molar Refractivity: 44.18 cm³; (9)Molar Volume: 135.6 cm³; (10)Polarizability: 17.51×10^-24cm³; (11)Surface Tension: 48.2 dyne/cm; (12)Density: 1.07 g/cm³; (13)Flash Point: 148.7 °C; (14)Enthalpy of Vaporization: 56.41 kJ/mol; (15)Boiling Point: 322.2 °C at 760 mmHg; (16)Vapour Pressure: 0.000283 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin, so you should wear suitable protective clothing when you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
1.SMILES: N#Cc1cc(c(N)c(c1)C)C
2.InChI: InChI=1/C9H10N2/c1-6-3-8(5-10)4-7(2)9(6)11/h3-4H,11H2,1-2H3
3.InChIKey: HRWCKMHTQMYUSL-UHFFFAOYAK

Product Name

4-AMINO-3,5-DIMETHYL-BENZONITRILE

4-Amino-3,5-dimethylbenzonitrile Specification

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