Propynamide

C₃H₃NOCAS 7341-96-069.06 g/mol

Open in Covalent MOL file

Alkyne Amide

Properties

Molecular formula: C₃H₃NO
Molar mass: 69.06 g/mol
Exact mass: 69.0215 Da
logP: -0.90Crippen estimate
Polar surface area: 43.1 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 0

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation97.6% of notifiers

Aggregated from 41 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

7341-96-0

SMILES

C#CC(=O)N

InChIKey

HCJTYESURSHXNB-UHFFFAOYSA-N

InChI

InChI=1S/C3H3NO/c1-2-3(4)5/h1H,(H2,4,5)

Weigh it out

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

Names and synonyms

7 names

Prop-2-ynamide
Propiolamide
2-Propynamide
Propiolic acid amide
Propargylamide
HC.equiv.CCONH2
Propynoic acid amide,

Work with Propynamide

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

3-Butyn-2-one1423-60-536 % similar Propiolic acid471-25-036 % similar Methyl propiolate922-67-832 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Isoxazole288-14-2 Oxazole288-42-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook