3-Decyn-1-ol

C10H18OCAS 51721-39-2154.25 g/mol

Open in Covalent MOL file
OH
AlcoholAlkyne

Properties

Molecular formula
C10H18O
Molar mass
154.25 g/mol
Exact mass
154.1358 Da
logP
2.34Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
5

Hazards

Warning
Irritant (GHS07)

Aggregated from 44 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
51721-39-2
SMILES
CCCCCCC#CCCO
InChIKey
YGEQBZUDPQQIFI-UHFFFAOYSA-N
InChI
InChI=1S/C10H18O/c1-2-3-4-5-6-7-8-9-10-11/h11H,2-6,9-10H2,1H3

Weigh it out

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

Work with 3-Decyn-1-ol

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

Non-3-yn-1-ol31333-13-895 % similar 7-Hexadecyn-1-ol822-21-983 % similar 3-Octyn-1-ol14916-80-482 % similar 11-Hexadecyn-1-ol65686-49-975 % similar 5-Dodecyne19780-12-268 % similar 2-Decyn-1-ol4117-14-068 % similar Non-2-yn-1-ol5921-73-368 % similar 6-Dodecyne6975-99-167 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

p-Menthan-3-one10458-14-7 (-)-α-Terpineol10482-56-1 3-Decen-2-one10519-33-2 Citric106-23-0 Geraniol106-24-1 Nerol106-25-2 Isoborneol124-76-5 (-)-Linalool126-91-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook