3-Fluoro-2-nitrophenol supplier

Name
3-Fluoro-2-nitrophenol
EINECS
CAS No. 385-01-3
Article Data10
CAS DataBase
Density 1.511 g/cm³
Solubility
Melting Point 37-38 °C
Formula C₆H₄FNO₃
Boiling Point 237.6 °C at 760 mmHg
Molecular Weight 157.101
Flash Point 97.5 °C
Transport Information
Appearance
Safety 36/37/39-45
Risk Codes 34
Molecular Structure
Hazard Symbols Xi
Synonyms 2-Nitro-3-fluorophenol;3-Fluoro-2-nitrophenol;AC1MD32D;MolPort-001-775-247;SBB063651;FT-0080424;CID2782777;
PSA 66.05000
LogP 1.96270

3-Fluoro-2-nitrophenol Specification

The 3-Fluoro-2-nitrophenol with CAS registry number of 385-01-3 is also known as 2-Nitro-3-fluorophenol. The IUPAC name and product name are the same. It belongs to product categories of Phenol&Thiophenol&Mercaptan. In addition, the formula is C₆H₄FNO₃ and the molecular weight is 157.10.

Physical properties about 3-Fluoro-2-nitrophenol are: (1)ACD/LogP: 1.85; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.08; (4)ACD/LogD (pH 7.4): -1.22; (5)ACD/BCF (pH 5.5): 1 ACD; (6)/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 2.87; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Index of Refraction: 1.581; (13)Molar Refractivity: 34.67 cm³; (14)Molar Volume: 103.9 cm³; (15)Surface Tension: 56.4 dyne/cm; (16)Density: 1.511 g/cm³; (17)Flash Point: 97.5 °C; (18)Enthalpy of Vaporization: 49.37 kJ/mol; (19)Boiling Point: 237.6 °C at 760 mmHg; (20)Vapour Pressure: 0.0289 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
1. Canonical SMILES: C1=CC(=C(C(=C1)F)[N+](=O)[O-])O
2. InChI: InChI=1S/C6H4FNO3/c7-4-2-1-3-5(9)6(4)8(10)11/h1-3,9H
3. InChIKey: GAWNBKUTBVLIPL-UHFFFAOYSA-N

Product Name

3-Fluoro-2-nitrophenol

3-Fluoro-2-nitrophenol Specification

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