7-Aminoflunitrazepam-D7

Base Information

• Chemical Name: 7-Aminoflunitrazepam-D7
• CAS No.: 879894-27-6
• Molecular Formula: C16H14FN3O
• Molecular Weight: 290.34
• European Community (EC) Number: 804-563-0
• DSSTox Substance ID: DTXSID101024711
• Mol file: 879894-27-6.mol

Synonyms:7-Aminoflunitrazepam-D7;879894-27-6;7-amino-5-(2,3,4,5-tetradeuterio-6-fluorophenyl)-1-(trideuteriomethyl)-3H-1,4-benzodiazepin-2-one;7-Aminoflunitrazepam D7;DTXSID101024711;PD053650;7-Aminoflunitrazepam-D7 0.1 mg/ml in Acetonitrile;7-Aminoflunitrazepam-D7 1.0 mg/ml in Acetonitrile;7-amino-5-[2-fluoro(3,4,5,6-?H?)phenyl]-1-(?H?)methyl-2,3-dihydro-1H-1,4-benzodiazepin-2-one

Chemical Property of 7-Aminoflunitrazepam-D7

Chemical Property:

• Storage Temp.: 2-8°C
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 290.15602746
• Heavy Atom Count: 21
• Complexity: 439

Purity/Quality:

99% ^*data from raw suppliers

7-Aminoflunitrazepam-d7 solution 100?μg/mL in acetonitrile, ampule of 1?mL, certified reference material, Cerilliant? ^*data from reagent suppliers

Safty Information:

• Hazard Codes: F,Xn
• Statements: 11-20/21/22-36
• Safety Statements: 16-36/37

MSDS Files:

Useful:

• Canonical SMILES: CN1C(=O)CN=C(C2=C1C=CC(=C2)N)C3=CC=CC=C3F
• Isomeric SMILES: [2H]C1=C(C(=C(C(=C1[2H])C2=NCC(=O)N(C3=C2C=C(C=C3)N)C([2H])([2H])[2H])F)[2H])[2H]
• Description: 7-Aminoflunitrazepam-d7 (Item No. 19055) is a certified reference material that is intended for use as an internal standard for the quantification of 7-aminoflunitrazepam by GC- or LC-MS. 7-Aminoflunitrazepam is the main urinary metabolite of flunitrazepam that can be detected in urine specimens following flunitrazepam use. This product is intended for research and forensic applications.