4920-77-8 | 3-Methyl-2-nitrophenol

Packsize	Purity	Availability	Price	Discounted Price
5g	98%	in stock	$13.00	$9.00
10g	98%	in stock	$16.00	$11.00
25g	98%	in stock	$20.00	$14.00

Description

• Catalog Number: AI51063
• Chemical Name: 3-Methyl-2-nitrophenol
• CAS Number: 4920-77-8
• Molecular Formula: C7H7NO3
• Molecular Weight: 153.1354
• MDL Number: MFCD00007125
• SMILES: O=N(=O)c1c(C)cccc1O
• NSC Number: 41206

Computed Properties

• Complexity: 154
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 11
• Hydrogen Bond Acceptor Count: 3
• Hydrogen Bond Donor Count: 1
• XLogP3: 2.3

Literature

• Spectroscopic (FT-IR, FT-Raman and UV-vis) investigation and frontier molecular orbitals analysis on 3-methyl-2-nitrophenol using hybrid computational calculations.

  Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20120201

• Pesticide by-products in the Rhône delta (Southern France). The case of 4-chloro-2-methylphenol and of its nitroderivative.

  Chemosphere 20090101

• Investigations on the gas-phase photolysis and OH radical kinetics of methyl-2-nitrophenols.

  Physical chemistry chemical physics : PCCP 20071114