chempirical

2-Propylpyridine

C8H11NCAS 622-39-9121.18 g/mol

Open in Covalent MOL file
N

Properties

Molecular formula
C8H11N
Molar mass
121.18 g/mol
Exact mass
121.0891 Da
Density
0.9119 g/mL (at 20 °C)
Melting point
2 °C
Boiling point
167 °C
logP
2.03Crippen estimate
Polar surface area
12.9 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
2

Identifiers

CAS number
622-39-9
SMILES
CCCc1ccccn1
InChIKey
OIALIKXMLIAOSN-UHFFFAOYSA-N
InChI
InChI=1S/C8H11N/c1-2-5-8-6-3-4-7-9-8/h3-4,6-7H,2,5H2,1H3

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

5 names
  • Pyridine, 2-propyl-
  • Conyrine
  • 1-(2-Pyridyl)propane
  • 2-n-Propylpyridine
  • NSC 966

Work with 2-Propylpyridine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2-Butylpyridine5058-19-577 % similar 2-Pentylpyridine2294-76-074 % similar 2-Hexylpyridine1129-69-771 % similar 2-Ethylpyridine100-71-062 % similar 2-Pyridineethanol103-74-257 % similar 2-(3-Phenylpropyl)pyridine2110-18-157 % similar 2-Pyridylethylamine2706-56-157 % similar Betahistine5638-76-657 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

3-Methylbenzylamine100-81-2 N-Methylbenzylamine103-67-3 N-Ethylaniline103-69-5 4-Methylbenzylamine104-84-7 5-Ethyl-2-methylpyridine104-90-5 3,5-Xylidine108-69-0 2,4,6-Trimethylpyridine108-75-8 4-Propylpyridine1122-81-2

Elsewhere

PubChem CAS Common Chemistry NIST WebBook