N-[3-(1,3-benzoxazol-2-yl)-4-hydroxyphenyl]-2-(4-chloro-3-methylphenoxy)acetamide

Base Information

• Chemical Name: N-[3-(1,3-benzoxazol-2-yl)-4-hydroxyphenyl]-2-(4-chloro-3-methylphenoxy)acetamide
• CAS No.: 6013-75-8
• Molecular Formula: C12H16 N2 O . 2 Cl H
• Molecular Weight: 408.8344
• DSSTox Substance ID: DTXSID30417324
• Wikidata: Q82227158
• Mol file: 6013-75-8.mol

Synonyms:6013-75-8;AC1NT6EH;CBKinase1_001291;CBKinase1_013691;Cambridge id 6013758;Oprea1_795110;DTXSID30417324;Cytisine, N-methyl-, dihydrochloride;EU-0038072;SR-01000431500;SR-01000431500-1;BRD-K38427224-001-01-4;N-[3-(1,3-benzoxazol-2-yl)-4-hydroxyphenyl]-2-(4-chloro-3-methylphenoxy)acetamide;1,5-Methano-8H-pyrido[1,2-a][1,5]diazocin-8-one, 1,2,3,4,5,6-hexahydro-3-methyl-, dihydrochloride, (1R)-

Chemical Property of N-[3-(1,3-benzoxazol-2-yl)-4-hydroxyphenyl]-2-(4-chloro-3-methylphenoxy)acetamide

Chemical Property:

• Vapor Pressure: 8.45E-14mmHg at 25°C
• Boiling Point: 587.9°Cat760mmHg
• Flash Point: 309.3°C
• Density: 1.42g/cm³
• XLogP3: 4.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 408.0876847
• Heavy Atom Count: 29
• Complexity: 565

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=CC(=C1)OCC(=O)NC2=CC(=C(C=C2)O)C3=NC4=CC=CC=C4O3)Cl