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1,1'-(2-Butyne-1,4-diyl)bis(pyrrolidine)

HCID 5534
NotesReactions
Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
51-73-0
Standard SMILES
C(#CCN1CCCC1)CN1CCCC1
InChIKey
JSUAJTLKVREZHV-UHFFFAOYSA-N
Molecular formula
C12H20N2
Average molar mass
192.3 g/mol
Monoisotopic mass
192.16264865

Overview

1-[4-(1-pyrrolidinyl)but-2-ynyl]pyrrolidine is a N-alkylpyrrolidine.

Names & identifiers

Preferred name
1,1'-(2-Butyne-1,4-diyl)bis(pyrrolidine)
IUPAC
1-(4-pyrrolidin-1-ylbut-2-ynyl)pyrrolidine
English name
1 1-(2-Butynylene)dipyrrolidine dihydrochloride 97%
Molecular formula
C12H20N2
Molecular weight
192.3

Names & synonyms

TremorineBioferminTremorin51-73-01,4-Dipyrrolidino-2-butyne1,4-Dipyrrolidinyl-2-butynePyrrolidine, 1,1'-(2-butyne-1,4-diyl)bis-U817VZ1URQDTXSID00199004NSC-407428RefChem:389340DTXCID90121495
Show more names
1,4-Di(1-pyrrolidyl)-2-butyne1,4-Dipyrrolidino-2-butynedi2HCl1,4-Bis(1-pyrrolidinyl)-2-butyne1,1'-(2-Butynylene)dipyrrolidine1,4-Bis(pyrrolidine-1-yl)-2-butyne1,1'-(2-Butyne-1,4-diyl)bispyrrolidine1 4-DIPYRROLIDINO-2-BUTYNE DIHYDROCHLORIDE 97%1 1-(2-Butynylene)dipyrrolidine dihydrochloride 97%
1,1'-(2-Butyne-1,4-diyl)bis(pyrrolidine)1,4-Dipyrrolidine-2-butyne1-(4-pyrrolidin-1-ylbut-2-ynyl)pyrrolidineNSC 4074282-Butyne, 1,4-bis(1-pyrrolidinyl)-Dipyrrolidine, 1,1'-(2-butynylene)-Pyrrolidine, 1,1'-(2-butynylene)di-UNII-U817VZ1URQ

Database identifiers

CAS
51-73-0

Properties

Computed structural properties

XLogP
1.3
Topological polar surface area
6.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
14
Formal charge
0
Complexity
201

Physicochemical properties

Melting point
25 °C · 25°C
Boiling point
2.5 · bp2.5 116-116.5°; bp 0.1 93-95°
Density
1.0076 · 1.0076 (rough estimate)
refractive index
1.52 · 1.5200 (estimate)
FDA UNII
817 VZ1URQ · U817VZ1URQ
RIDADR
2810 · 2810
HazardClass
6.1 · 6.1(b)
PackingGroup
III

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

ridadr
2810
hazard_class
6.1(b)
packing_group
III

Chemistry & industry

Suppliers1 total

TargetMol 中国(陶术生物)400-821-0310 15002144251 · [email protected]

Additional notes

DefinitionChEBI: 1-[4-(1-pyrrolidinyl)but-2-ynyl]pyrrolidine is a N-alkylpyrrolidine.

Related reactions

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Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
PubChem CID
5534
DTXSID
DTXSID00199004
ChEMBL
CHEMBL1483237
ChEBI
CHEBI:92148
UNII
U817VZ1URQ
Nikkaji
J4.126B