Yfg7XE25DV

Base Information

• Chemical Name: Yfg7XE25DV
• CAS No.: 111581-85-2
• Molecular Formula: C25H28 N2 O5
• Molecular Weight: 436.5002
• UNII: YFG7XE25DV
• DSSTox Substance ID: DTXSID50149690
• Nikkaji Number: J524.888D
• Mol file: 111581-85-2.mol

Synonyms:7-(1-carboxy-3-phenylpropyl)amino-1,2,3,4,6,7,8,12b-octahydro-6-oxopyrido(2,1a)-2-benzazepine-4-carboxylic acid;MDL 27088;MDL-27,088

Chemical Property of Yfg7XE25DV

Chemical Property:

• Vapor Pressure: 4.45E-21mmHg at 25°C
• Boiling Point: 708.7°Cat760mmHg
• Flash Point: 382.4°C
• Density: 1.34g/cm³
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 7
• Exact Mass: 436.19982200
• Heavy Atom Count: 32
• Complexity: 692

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC2C3=CC=CC=C3CC(C(=O)N2C(C1)C(=O)O)NC(CCC4=CC=CC=C4)C(=O)O
• Isomeric SMILES: C1C[C@@H]2C3=CC=CC=C3C[C@@H](C(=O)N2[C@@H](C1)C(=O)O)N[C@@H](CCC4=CC=CC=C4)C(=O)O