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CAS No.: | 135050-44-1 |
---|---|
Name: | 3-CHLORO-4-IODOANILINE |
Article Data: | 17 |
Molecular Structure: | |
Formula: | C6H5ClIN |
Molecular Weight: | 253.47 |
Synonyms: | 3-Chloro-4-iodoaniline;3-Chloro-4-iodophenylamine;NSC 137036; |
Density: | 2.015 g/cm3 |
Melting Point: | 65-71 °C |
Boiling Point: | 312.8 °C at 760 mmHg |
Flash Point: | 143 °C |
Appearance: | greyish-green crystalline powder |
Hazard Symbols: | Xn,Xi |
Risk Codes: | 36/37/38-20/21/22 |
Safety: | 36/37/39-26 |
PSA: | 26.02000 |
LogP: | 3.10800 |
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The Benzenamine,3-chloro-4-iodo- is an organic compound with the formula C6H5ClIN. The IUPAC name of this chemical is 3-chloro-4-iodoaniline. With the CAS registry number 135050-44-1, it is also named as 4-Amino-2-chloroiodobenzene. The product's categories are Anilines, Amides & Amines; Chlorine Compounds; Iodine Compounds. Besides, it is a greyish-green crystalline powder, which should be stored in a closed cool and dry place.
Physical properties about Benzenamine,3-chloro-4-iodo- are: (1)ACD/LogP: 3.48; (2)#H bond acceptors: 1; (3)#H bond donors: 2; (4)#Freely Rotating Bonds: 1; (5)Polar Surface Area: 3.24 Å2; (6)Index of Refraction: 1.694; (7)Molar Refractivity: 48.29 cm3; (8)Molar Volume: 125.7 cm3; (9)Polarizability: 19.14×10-24cm3; (10)Surface Tension: 56.4 dyne/cm; (11)Density: 2.015 g/cm3; (12)Flash Point: 143 °C; (13)Enthalpy of Vaporization: 55.38 kJ/mol; (14)Boiling Point: 312.8 °C at 760 mmHg; (15)Vapour Pressure: 0.000518 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
It is harmful by inhalation, in contact with skin and if swallowed. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. Besides, this chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable gloves and eye/face protection.
You can still convert the following datas into molecular structure:
(1)SMILES: Ic1ccc(N)cc1Cl
(2)InChI: InChI=1/C6H5ClIN/c7-5-3-4(9)1-2-6(5)8/h1-3H,9H2
(3)InChIKey: ONZHMGRKWJMTDE-UHFFFAOYAE
(4)Std. InChI: InChI=1S/C6H5ClIN/c7-5-3-4(9)1-2-6(5)8/h1-3H,9H2
(5)Std. InChIKey: ONZHMGRKWJMTDE-UHFFFAOYSA-N