1758-46-9 | 2-Phenoxyethylamine

Packsize	Purity	Availability	Price	Discounted Price
5g	98%	in stock	$17.00	$12.00
10g	98%	in stock	$28.00	$20.00
25g	98%	in stock	$35.00	$25.00
100g	98%	in stock	$140.00	$98.00

Description

• Catalog Number: AA94684
• Chemical Name: 2-Phenoxyethylamine
• CAS Number: 1758-46-9
• Molecular Formula: C8H11NO
• Molecular Weight: 137.17904000000001
• MDL Number: MFCD00052975
• SMILES: NCCOc1ccccc1

Computed Properties

• Complexity: 79.3
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 10
• Hydrogen Bond Acceptor Count: 2
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 3
• XLogP3: 0.9

Literature

• Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

  Bioorganic & medicinal chemistry letters 20101101

• Amiodarone and its putative metabolites fail to activate wild type hTAAR1.

  Bioorganic & medicinal chemistry letters 20091015

• Discovery of novel phenethylpyridone derivatives as potent melanin-concentrating hormone 1 receptor antagonists.

  Bioorganic & medicinal chemistry letters 20090901

• Switchable V-type [2]pseudorotaxanes.

  Organic letters 20090806

• In silico elucidation of the molecular mechanism defining the adverse effect of selective estrogen receptor modulators.

  PLoS computational biology 20071101

• New efficient substrates for semicarbazide-sensitive amine oxidase/VAP-1 enzyme: analysis by SARs and computational docking.

  Journal of medicinal chemistry 20061019

• QSAR of estrogen receptor modulators: exploring selectivity requirements for ER(alpha) versus ER(beta) binding of tetrahydroisoquinoline derivatives using E-state and physicochemical parameters.

  Bioorganic & medicinal chemistry letters 20050215

• Syntheses of 1,4-benzothiazepines and 1,4-benzoxazepines via cyclizations of 1-[2-arylthio(oxy)ethyl]-5-benzotriazolyl-2-pyrrolidinones and 3-benzotriazolyl-2-[2-arylthio(oxy)ethyl]-1-isoindolinones.

  The Journal of organic chemistry 20010810