2H-1-Benzopyran-6-carbonitrile, 3,4-dihydro-2,2-dimethyl-3-hydroxy-4-((4-methyl-5-oxo-3,4-diazabicyclo(4.1.0)hept-2-en-2-yl)oxy)-

Base Information

• Chemical Name: 2H-1-Benzopyran-6-carbonitrile, 3,4-dihydro-2,2-dimethyl-3-hydroxy-4-((4-methyl-5-oxo-3,4-diazabicyclo(4.1.0)hept-2-en-2-yl)oxy)-
• CAS No.: 154186-66-0
• Molecular Formula: C18H19 N3 O4
• Molecular Weight: 341.3612
• DSSTox Substance ID: DTXSID10934948
• ChEMBL ID: CHEMBL136869
• Mol file: 154186-66-0.mol

Synonyms:154186-66-0;2H-1-Benzopyran-6-carbonitrile, 3,4-dihydro-2,2-dimethyl-3-hydroxy-4-((4-methyl-5-oxo-3,4-diazabicyclo(4.1.0)hept-2-en-2-yl)oxy)-;CHEMBL136869;SCHEMBL7867663;DTXSID10934948;LS-39015;3-Hydroxy-2,2-dimethyl-4-[(4-methyl-5-oxo-3,4-diazabicyclo[4.1.0]hept-2-en-2-yl)oxy]-3,4-dihydro-2H-1-benzopyran-6-carbonitrile

Chemical Property of 2H-1-Benzopyran-6-carbonitrile, 3,4-dihydro-2,2-dimethyl-3-hydroxy-4-((4-methyl-5-oxo-3,4-diazabicyclo(4.1.0)hept-2-en-2-yl)oxy)-

Chemical Property:

• Vapor Pressure: 1.65E-10mmHg at 25°C
• Boiling Point: 492.3°Cat760mmHg
• Flash Point: 251.6°C
• Density: 1.47g/cm³
• XLogP3: 0.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 2
• Exact Mass: 341.13755610
• Heavy Atom Count: 25
• Complexity: 667

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1(C(C(C2=C(O1)C=CC(=C2)C#N)OC3=NN(C(=O)C4C3C4)C)O)C