Basic information
- CAS
300-68-5- Standard SMILES
C(#CCN1CCCC1)CN1CCCC1.Cl.Cl- InChIKey
ASHYBFCDTYPECZ-UHFFFAOYSA-N- Molecular formula
- C12H22Cl2N2
- Average molar mass
- 265.22 g/mol
- Monoisotopic mass
- 264.1160041
Names & identifiers
- Preferred name
- 1,1'-But-2-ynylenedipyrrolidinium dichloride
- IUPAC
- 1-(4-pyrrolidin-1-ylbut-2-ynyl)pyrrolidine;dihydrochloride
Names & synonyms
1,1'-But-2-ynylenedipyrrolidinium dichlorideRefChem:409233206-097-8Tremorine dihydrochloride300-68-51-(4-pyrrolidin-1-ylbut-2-ynyl)pyrrolidine;dihydrochlorideTremorine dichlorohydrateTremorine HClEINECS 206-097-81,1'-(2-Butynylene)dipyrrolidine dihydrochloridePrestwick_479Pyrrolidine, 1,1'-(2-butynylene)di-, dihydrochloride
Show more names
SCHEMBL3757253DTXSID10184082ASHYBFCDTYPECZ-UHFFFAOYSA-NHMS1569C03Pyrrolidine, 1,1'-(2-butyne-1,4-diyl)bis-, dihydrochlorideCCG-220331ST50448544SR-01000872650
Database identifiers
- CAS
300-68-5- PubChem CID
- 71074
- DTXSID
DTXSID10184082- EC Number
- 206-097-8
Properties
Computed structural properties
- Topological polar surface area
- 6.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 201
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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