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35113-88-3

Basic Information
CAS No.: 35113-88-3
Name: N1-METHYL-2,4-DICHLOROANILINE
Article Data: 5
Molecular Structure:
Molecular Structure of 35113-88-3 (N1-METHYL-2,4-DICHLOROANILINE)
Formula: C7H7Cl2N
Molecular Weight: 176.045
Synonyms: 2,4-Dichloro-N-methylbenzenamine;2,4-Dichloro-N-methylaniline;N-Methyl-2,4-dichloroaniline;
Density: 1.325 g/cm3
Melting Point: 28-32 °C(lit.)
Boiling Point: 272.3 °C at 760 mmHg
Flash Point: 118.5 °C
Hazard Symbols: ToxicT
Risk Codes: 25-41-43-52/53
Safety: 26-37/39-45
Transport Information: UN 2811
PSA: 12.03000
LogP: 3.10810
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Specification

The Benzenamine,2,4-dichloro-N-methyl-, with the CAS registry number 35113-88-3, is also known as N-Methyl-2,4-dichloroaniline. It belongs to the product categories of Amines; C7; Nitrogen Compounds. This chemical's molecular formula is C7H7Cl2N and molecular weight is 176.04. What's more, its systematic name is 2,4-dichloro-N-methylaniline. 

Physical properties of Benzenamine,2,4-dichloro-N-methyl- are: (1)ACD/LogP: 2.89; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.89; (4)ACD/BCF (pH 5.5): 93.04; (5)ACD/BCF (pH 7.4): 93.13; (6)ACD/KOC (pH 5.5): 892.64; (7)ACD/KOC (pH 7.4): 893.48; (8)#H bond acceptors: 1; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 3.24 Å2; (12)Index of Refraction: 1.603; (13)Molar Refractivity: 45.65 cm3; (14)Molar Volume: 132.7 cm3; (15)Surface Tension: 41.9 dyne/cm; (16)Density: 1.325 g/cm3; (17)Flash Point: 118.5 °C; (18)Enthalpy of Vaporization: 51.06 kJ/mol; (19)Boiling Point: 272.3 °C at 760 mmHg; (20)Vapour Pressure: 0.00613 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
It is toxic if swallowed. It has the risk of serious damage to eyes. It may cause sensitisation by skin contact. It is harmful to aquatic organisms as it may cause long-term adverse effects in the aquatic environment. In case of contacting with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing and gloves. In case of accident or if you feel unwell seek medical advice immediately (show the label where possible).

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cc(Cl)ccc1NC
(2)InChI: InChI=1S/C7H7Cl2N/c1-10-7-3-2-5(8)4-6(7)9/h2-4,10H,1H3
(3)InChIKey: DDBLVMDBBKQXTA-UHFFFAOYSA-N