Benzenamine,4-chloro-N-2-propen-1-yl- supplier

Name
4-Chloro-N-allylaniline
EINECS
CAS No. 13519-80-7
Article Data43
CAS DataBase
Density 1.125 g/cm³
Solubility
Melting Point
Formula C₉H₁₀ClN
Boiling Point 272.9 °C at 760 mmHg
Molecular Weight 167.638
Flash Point 118.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Aniline,N-allyl-p-chloro- (8CI);Benzenamine, 4-chloro-N-2-propenyl- (9CI);N-Allyl-4-chloroaniline;N-Allyl-p-chloroaniline;NSC 73155;4-Chloro-N-(prop-2-en-1-yl)aniline;
PSA 12.03000
LogP 3.01090

Benzenamine,4-chloro-N-2-propen-1-yl- Specification

The Benzenamine,4-chloro-N-2-propen-1-yl-, with the CAS registry number 13519-80-7, is also known as N-Allyl-4-chloroaniline. This chemical's molecular formula is C₉H₁₀ClN and molecular weight is 167.64. What's more, its systematic name is 4-chloro-N-(prop-2-en-1-yl)aniline.

Physical properties of Benzenamine,4-chloro-N-2-propen-1-yl- are: (1)ACD/LogP: 3.10; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 3.24 Å²; (7)Index of Refraction: 1.582; (8)Molar Refractivity: 49.74 cm³; (9)Molar Volume: 148.9 cm³; (10)Polarizability: 19.72×10^-24cm³; (11)Surface Tension: 38.3 dyne/cm; (12)Density: 1.125 g/cm³; (13)Flash Point: 118.9 °C; (14)Enthalpy of Vaporization: 51.13 kJ/mol; (15)Boiling Point: 272.9 °C at 760 mmHg; (16)Vapour Pressure: 0.0059 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1ccc(NC\C=C)cc1
(2)InChI: InChI=1S/C9H10ClN/c1-2-7-11-9-5-3-8(10)4-6-9/h2-6,11H,1,7H2
(3)InChIKey: MFBBLCDOQHNWPL-UHFFFAOYSA-N

Product Name

4-Chloro-N-allylaniline

Benzenamine,4-chloro-N-2-propen-1-yl- Specification

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