3-[(2-Propynyloxy)methyl]pyrrolidine hydrochloride
Basic information
- CAS
1220036-53-2- Standard SMILES
C#CCOCC1CCNC1.Cl- InChIKey
QUDORQVWQPNOSV-UHFFFAOYSA-N- Molecular formula
- C8H14ClNO
- Average molar mass
- 175.65 g/mol
- Monoisotopic mass
- 175.0763918
Names & identifiers
- Preferred name
- 3-[(2-Propynyloxy)methyl]pyrrolidine hydrochloride
- IUPAC
- 3-(prop-2-ynoxymethyl)pyrrolidine;hydrochloride
- English name
- 3-[(2-Propynyloxy)methyl]pyrrolidine hydrochloride
- Molecular formula
- C8H14ClNO
- Molecular weight
- 175.65586
Names & synonyms
1220036-53-23-[(2-PROPYNYLOXY)METHYL]PYRROLIDINE HYDROCHLORIDE3-((Prop-2-yn-1-yloxy)methyl)pyrrolidine hydrochloride3-(prop-2-ynoxymethyl)pyrrolidine;hydrochloride3-[(prop-2-yn-1-yloxy)methyl]pyrrolidine hydrochlorideSCHEMBL28932911MFCD13560225AKOS015847390G650783-((prop-2-ynyloxy)methyl)pyrrolidine hydrochloride3-((Prop-2-yn-1-yloxy)methyl)pyrrolidinehydrochloride
Database identifiers
- CAS
1220036-53-2- PubChem CID
- 53409409
Properties
Computed structural properties
- Topological polar surface area
- 21.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 135
Physicochemical properties
- HazardClass
- IRRITANT
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hazard_class
- IRRITANT
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Related reactions
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Compound notes
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