trans-3'-Hydroxy Cotinine-d3

Base Information

• Chemical Name: trans-3'-Hydroxy Cotinine-d3
• CAS No.: 159956-78-2
• Molecular Formula: C11H13D3N2O
• Molecular Weight: 195.28
• European Community (EC) Number: 806-384-3
• Mol file: 159956-78-2.mol

Synonyms:trans-3'-Hydroxy Cotinine-d3;159956-78-2;(3R,5S)-3-Hydroxy Cotinine-d3;(3R,5S)-3-hydroxy-5-pyridin-3-yl-1-(trideuteriomethyl)pyrrolidin-2-one;3 hydroxy cotinine D3;Trans 3 Hydroxy Cotinine D3;CS-BU-00080;CS-BU-00091;trans-3'-Hydroxycotinine,methyl-d3;trans-3-Hydroxy-1-(methyl-d3)-5-(3-pyridinyl)-2-pyrrolidinone;CS-T-55903;HY-113239S;CS-0377120;TRANS-3/'-HYDROXYCOTININE, METHYL-D3;trans-3'-Hydroxy Cotinine-d3 (Racemic Mixtures);J-009658;(3R,5S)-3-hydroxy-1-(?H?)methyl-5-(pyridin-3-yl)pyrrolidin-2-one

Chemical Property of trans-3'-Hydroxy Cotinine-d3

Chemical Property:

• Melting Point: 103-106°C
• Flash Point: 9℃
• PSA: 53.43000
• LogP: 0.28360
• Storage Temp.: -20°C Freezer
• XLogP3: -0.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 195.108707868
• Heavy Atom Count: 14
• Complexity: 232

Purity/Quality:

98%,99%, ^*data from raw suppliers

rel-trans-3''-HydroxyCotinine-d3(RacemicMixture) ^*data from reagent suppliers

Safty Information:

• Hazard Codes: F,T
• Statements: 11-23/24/25-39/23/24/25
• Safety Statements: 7-16-36/37-45

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1C(CC(C1=O)O)C2=CN=CC=C2
• Isomeric SMILES: [2H]C([2H])([2H])N1[C@@H](C[C@H](C1=O)O)C2=CN=CC=C2
• Uses: A labelled metabolite of Nicotine. Carcinogen.-20?C Freezer A labelled metabolite of Nicotine. Carcinogen.( -20?C Freezer)