5-Bromoquinazolin-6-ylthiourea supplier

Name
5-Bromoquinazolin-6-ylthiourea
EINECS 688-604-6
CAS No. 842138-74-3
Density 1.835 g/cm³
Solubility
Melting Point 198-202 °C
Formula C₉H₇BrN₄S
Boiling Point 435.4 °C at 760 mmHg
Molecular Weight 283.15
Flash Point 217.1 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Thiourea,(5-bromo-6-quinoxalinyl)- (9CI);N-(5-bromo-6-quinoxalinyl)thioure;(5-bromoquinoxalin-6-yl)thiourea;thiourea, N-(5-bromo-6-quinoxalinyl)-;
PSA 95.92000
LogP 2.82110

5-Bromoquinazolin-6-ylthiourea Specification

The 5-Bromoquinazolin-6-ylthiourea, with the CAS registry number 842138-74-3, has the systematic name of (5-bromoquinoxalin-6-yl)thiourea. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of this chemical is C₉H₇BrN₄S.

The physical properties of 5-Bromoquinazolin-6-ylthiourea are as following: (1)ACD/LogP: 0.49; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.49; (4)ACD/LogD (pH 7.4): 0.49 ; (5)#H bond acceptors: 4; (6)#H bond donors: 3; (7)#Freely Rotating Bonds: 1; (8)Polar Surface Area: 95.92 Å²; (9)Index of Refraction: 1.84; (10)Molar Refractivity: 68.4 cm³; (11)Molar Volume: 154.3 cm³; (12)Polarizability: 27.11×10^-24cm³; (13)Surface Tension: 97 dyne/cm; (14)Density: 1.835 g/cm³; (15)Flash Point: 217.1 °C; (16)Enthalpy of Vaporization: 69.16 kJ/mol; (17)Boiling Point: 435.4 °C at 760 mmHg; (18)Vapour Pressure: 8.81E-08 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: c1cc(c(c2c1nccn2)Br)NC(=S)N
(2)InChI: InChI=1/C9H7BrN4S/c10-7-5(14-9(11)15)1-2-6-8(7)13-4-3-12-6/h1-4H,(H3,11,14,15)
(3)InChIKey: HURGDIYVXQDVMD-UHFFFAOYAL

Product Name

5-Bromoquinazolin-6-ylthiourea

5-Bromoquinazolin-6-ylthiourea Specification

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