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Piperidine, 4,4'-(1,3-propanediyl)bis[1-methyl-

HCID 116563
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Basic information

CAS
64168-11-2
Standard SMILES
CN1CCC(CCCC2CCN(C)CC2)CC1
InChIKey
JWOTWWORMYMZCR-UHFFFAOYSA-N
Molecular formula
C15H30N2
Average molar mass
238.419 g/mol
Monoisotopic mass
238.24089896

Names & identifiers

Preferred name
Piperidine, 4,4'-(1,3-propanediyl)bis[1-methyl-
IUPAC
4,4'-(Propane-1,3-diyl)bis(1-methylpiperidine)
English name
4,4'-Trimethylenebis(1-methylpiperidine)
Molecular formula
C15H30N2
Molecular weight
238.41

Names & synonyms

1,3-Bis(1-methyl-4-piperidyl)propane.4,4'-Trimethylenebis(1-methylpiperidine)4,4'-TriMethylenebis(1-Methylpiperidine)4,4'-Trimethylenebis(1-methylpiperidine),97%4,4’-(1,3-propanediyl)bis[1-methyl-piperidin4,4'-(1,3-Propanediyl)bis(1-methylpiperidine)4,4'-(propane-1,3-diyl)bis(1-methylpiperidine)4,4'-TRIMETHYLENEBIS(1-METHYLPIPERIDINE) , 98+%Piperidine, 4,4'-(1,3-propanediyl)bis[1-methyl-1-methyl-4-[3-(1-methyl-4-piperidyl)propyl]piperidine

Database identifiers

CAS
64168-11-2
PubChem CID
116563
DTXSID
DTXSID6070061
UNII
7SUV9QUZ6M
EC Number
264-717-2
Nikkaji
J236.490E

Properties

Physicochemical properties

Melting point
13 °C · 13 °C (lit.)
Boiling point
215 °C/50 · 215 °C/50 mmHg (lit.)
Density
0.896 g/mL · 0.896 g/mL at 25 °C (lit.)
refractive index
20 · n20/D 1.482(lit.)
Flash point
230 °F · >230 °F
pka
9.9 · 9.90±0.10(Predicted)
Sensitive
Air Sensitive
InChI
InChI=1S/C15H30N2/c1-16-10-6-14(7-11-16)4-3-5-15-8-12-17(2)13-9-15/h14-15H,3-13H2,1-2H3
InChIKey
JWOTWWORMYMZCR-UHFFFAOYSA-N
SMILES
C(C1CCN(C)CC1)CCC1CCN(C)CC1
CAS DataBase Reference
64168 · 64168-11-2
NIST Chemistry Reference
4 · 4,4'-Trimethylenebis(1-methylpiperidine)(64168-11-2)
EPA Substance Registry System
4 · Piperidine, 4,4'-(1,3-propanediyl)bis[1-methyl- (64168-11-2)
UNSPSC Code
12352100 · 12352100
NACRES
22 · NA.22
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
315 · H315-H319-H335
Precautionary statements
261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
target organs
Respiratory system
PPE
Eyeshields, Gloves, type ABEK (EN14387) respirator filter
Hazard Codes
Xi
Risk Statements
36 · 36/37/38
Safety Statements
26 · 26-37/39
WGK Germany
3 · 3
TSCA
TSCA listed
Storage Class
10 · 10 - Combustible liquids
Hazard Classifications
2 Skin · Eye Irrit. 2Skin Irrit. 2STOT SE 3

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

PPE
Eyeshields, Gloves, type ABEK (EN14387) respirator filter
wgk
3
tsca
TSCA listed
risk_code
36/37/38
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi
safety_code
26-37/39
Storage Class
10 - Combustible liquids
target organs
Respiratory system
Hazard statements
H315-H319-H335
Hazard Classifications
Eye Irrit. 2Skin Irrit. 2STOT SE 3
Precautionary statements
P261-P264-P271-P280-P302+P352-P305+P351+P338

Chemistry & industry

Applications · 1 item

Uses4,4′-Trimethylenebis(1-methylpiperidine) has been used in the synthesis of:di-, tri- and tetracationic monomeric and homodimeric monomethine cyanine dyes for nucleic acid detectionstructure directing agents containing 4,4′-trimethylenebis(1-methylpiperidine)piperidine-based dicationic ionic liquids

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