chempirical

1,5-Decadiyne

C10H14CAS 53963-03-4134.22 g/mol

Open in Covalent MOL file
Alkyne

Properties

Molecular formula
C10H14
Molar mass
134.22 g/mol
Exact mass
134.1096 Da
logP
2.59Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
3

Identifiers

CAS number
53963-03-4
SMILES
C#CCCC#CCCCC
InChIKey
IWIDILFDSIIOSB-UHFFFAOYSA-N
InChI
InChI=1S/C10H14/c1-3-5-7-9-10-8-6-4-2/h1H,4-8H2,2H3

Weigh it out

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

Work with 1,5-Decadiyne

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

1-Hexyne693-02-771 % similar 5-Decyne1942-46-765 % similar 1-Heptyne628-71-761 % similar 1-Undecyne2243-98-358 % similar 1-Heptadecyne26186-00-558 % similar 1-Tridecyne26186-02-758 % similar 1-Nonyne3452-09-358 % similar 1-Octyne629-05-058 % similar

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

Same formula

n-Butylbenzene104-51-8 1,4-Diethylbenzene105-05-5 1,2-Diethylbenzene135-01-3 sec-Butylbenzene135-98-8 1,3-Diethylbenzene141-93-5 1,9-Decadiyne1720-38-3 Prehnitene488-23-3 Isodurene527-53-7

Elsewhere

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