5-Chloro-1-pentyne

C₅H₇ClCAS 14267-92-6102.56 g/mol

Open in Covalent MOL file

Alkyl halide Alkyne

Properties

Molecular formula: C₅H₇Cl
Molar mass: 102.56 g/mol
Exact mass: 102.0236 Da
Density: 0.9695 g/mL (at 420 °C)
Melting point: 118–122 °C
Boiling point: 88 °C (at 350 Torr)
logP: 1.64Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 2

Identifiers

CAS number

14267-92-6

SMILES

C#CCCCCl

InChIKey

UXFIKVWAAMKFQE-UHFFFAOYSA-N

InChI

InChI=1S/C5H7Cl/c1-2-3-4-5-6/h1H,3-5H2

Weigh it out

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

Names and synonyms

4 names

1-Pentyne, 5-chloro-
1-Chloro-4-pentyne
4-Pentynyl chloride
(3-Chloropropyl)acetylene

Work with 5-Chloro-1-pentyne

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

6-Chloro-1-hexyne10297-06-083 % similar 1,6-Heptadiyne2396-63-659 % similar 1,7-Octadiyne871-84-159 % similar 1,9-Decadiyne1720-38-356 % similar 1,8-Nonadiyne2396-65-856 % similar 1,5-Hexadiyne628-16-047 % similar 4-Pentyn-1-ol5390-04-545 % similar 4-Chlorobutyronitrile628-20-645 % similar

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

Same formula

3-Chloro-3-methyl-1-butyne1111-97-3 1-Chloro-2-pentyne22592-15-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook