(3-Prop-1-ynylpyridin-4-yl)carbamic acid tert-butyl ester

Base Information

• Chemical Name: (3-Prop-1-ynylpyridin-4-yl)carbamic acid tert-butyl ester
• CAS No.: 211029-71-9
• Molecular Formula: C13H16N2O2
• Molecular Weight: 232.27800
• DSSTox Substance ID: DTXSID50452651
• Nikkaji Number: J981.207E
• Wikidata: Q82273408
• Mol file: 211029-71-9.mol

Synonyms:(3-prop-1-ynylpyridin-4-yl)carbamic acid tert-butyl ester;211029-71-9;SCHEMBL5777576;DTXSID50452651;DCTBMMMODOQZMY-UHFFFAOYSA-N;tert-butyl 3-(prop-1-ynyl)pyridin-4-ylcarbamate;3-(1-Propynyl)-4-pyridinylcarbamic acid tert-butyl ester

Chemical Property of (3-Prop-1-ynylpyridin-4-yl)carbamic acid tert-butyl ester

Chemical Property:

• PSA: 54.45000
• LogP: 2.22190
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 232.121177757
• Heavy Atom Count: 17
• Complexity: 332

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC#CC1=C(C=CN=C1)NC(=O)OC(C)(C)C