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30508-74-8

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Basic Information
CAS No.: 30508-74-8
Name: 6-(4-BROMOPHENYL)-1,3,5-TRIAZINE-2,4-DIAMINE
Article Data: 5
Molecular Structure:
Molecular Structure of 30508-74-8 (6-(4-BROMOPHENYL)-1,3,5-TRIAZINE-2,4-DIAMINE)
Formula: C9H8BrN5
Molecular Weight: 266.1
Synonyms: 1,3,5-Triazine-2,4-diamine, 6-(4-bromophenyl)-;6-(4-bromophenyl)-1,3,5-triazine-2,4-diamine;
Density: 1.715 g/cm3
Melting Point: 264-268 °C(lit.)
Boiling Point: 528.8 °C at 760 mmHg
Flash Point: 273.6 °C
Hazard Symbols: HarmfulXn
Risk Codes: 22-36/37/38
Safety: 26-36-45
PSA: 90.71000
LogP: 2.62790
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Specification

The 2,4-Diamino-6-(4-bromophenyl)-1,3,5-triazine, with the CAS registry number 30508-74-8, is also known as 1,3,5-Triazine-2,4-diamine, 6-(4-bromophenyl)-. It belongs to the product categories of Triazines Building Blocks; Halogenated Heterocycles; Heterocyclic Building Blocks; Triazines. This chemical's molecular formula is C9H8BrN5 and molecular weight is 266.1. Its systematic name is called 6-(4-bromophenyl)-1,3,5-triazine-2,4-diamine. What's more, the product should be sealed and stored in cool and dry place.

Physical properties of 2,4-Diamino-6-(4-bromophenyl)-1,3,5-triazine: (1)(ChemAxon) ACD/LogP: 2.30; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.29; (4)ACD/LogD (pH 7.4): 2.3; (5)ACD/BCF (pH 5.5): 32.46; (6)ACD/BCF (pH 7.4): 33; (7)ACD/KOC (pH 5.5): 418.27; (8)ACD/KOC (pH 7.4): 425.11; (9)#H bond acceptors: 5; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 1; (12)Index of Refraction: 1.72; (13)Molar Refractivity: 61.28 cm3; (14)Molar Volume: 155.1 cm3; (15)Surface Tension: 80.8 dyne/cm; (16)Density: 1.715 g/cm3; (17)Flash Point: 273.6 °C; (18)Enthalpy of Vaporization: 80.37 kJ/mol; (19)Boiling Point: 528.8 °C at 760 mmHg; (20)Vapour Pressure: 2.87E-11 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause damage to health. It is harmful if swallowed. In addition, it is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing. 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: Brc1ccc(cc1)c2nc(nc(n2)N)N
(2)InChI: InChI=1/C9H8BrN5/c10-6-3-1-5(2-4-6)7-13-8(11)15-9(12)14-7/h1-4H,(H4,11,12,13,14,15)
(3)InChIKey: IFTSWIQNKJOSLN-UHFFFAOYAX