2-Bromo-5-nitrobenzaldehyde supplier

Name
2-Bromo-5-nitrobenzaldehyde
EINECS 200-002-4
CAS No. 84459-32-5
Article Data23
CAS DataBase
Density 1.781 g/cm³
Solubility
Melting Point 103-104 °C
Formula C₇H₄BrNO₃
Boiling Point 307.174 °C at 760 mmHg
Molecular Weight 230.018
Flash Point 139.574 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Benzaldehyde, 2-bromo-5-nitro-;
PSA 62.89000
LogP 2.69300

2-Bromo-5-nitrobenzaldehyde Specification

The 2-Bromo-5-nitrobenzaldehyde, with the CAS registry number 84459-32-5, is also known as Benzaldehyde, 2-bromo-5-nitro-. This chemical's molecular formula is C₇H₄BrNO₃ and molecular weight is 230.02. What's more, both its IUPAC name and systematic name are the same which is called 2-Bromo-5-nitrobenzaldehyde.

Physical properties about 2-Bromo-5-nitrobenzaldehyde are: (1)ACD/LogP: 2.01; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 39; (6)ACD/BCF (pH 7.4): 39; (7)ACD/KOC (pH 5.5): 475; (8)ACD/KOC (pH 7.4): 475; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 62.89 Å²; (13)Index of Refraction: 1.653; (14)Molar Refractivity: 47.241 cm³; (15)Molar Volume: 129.126 cm³; (16)Surface Tension: 59.291 dyne/cm; (17)Density: 1.781 g/cm³; (18)Flash Point: 139.574 °C; (19)Enthalpy of Vaporization: 54.775 kJ/mol; (20)Boiling Point: 307.174 °C at 760 mmHg; (21)Vapour Pressure: 0.001 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=Cc1cc(ccc1Br)[N+]([O-])=O
(2) InChI: InChI=1S/C7H4BrNO3/c8-7-2-1-6(9(11)12)3-5(7)4-10/h1-4H
(3) InChIKey: LJASZNNBVOTAAN-UHFFFAOYSA-N

Product Name

2-Bromo-5-nitrobenzaldehyde

2-Bromo-5-nitrobenzaldehyde Specification

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