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4,4'-Trimethylenedipiperidine 97%

CAT: 0286-T27695Size: 25 gDry Ice: NoHazardous: No
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CAT#:0286-T27695Size:25 g
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CAS Number
16898-52-5
Synonyms
1,3-bis (4-Piperidyl) propane; 1,3-Di-4-piperidylpropane
Pictogram
07 - Irritant
UDF Signal Word
Warning
MDL Number
MFCD00038013
Hazard Statement
H302 Harmful if swallowed; H312 Harmful in contact with skin; H315 Causes skin irritation; H319 Causes serious eye irritation; H332 Harmful if inhaled; H335 May cause respiratory irritation.
DOT Name
Not D.O.T.-Regulated
Precautions
P261 Avoid breathing dust/fume/gas/mist/vapors/spray; P280 Wear protective gloves/protective clothing/eye protection/face protection; P301+P312 IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell; P302+P352 IF ON SKIN: wash with plenty of soap and water; P304+P340 IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing; P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing; P332+P313 IF SKIN irritation occurs: Get medical advice/attention.

Chemical Information

1,3-Bis(4-piperidinyl)propane

structure in first source

CAS Number16898-52-5
PubChem CID85631
IUPAC Name4-(3-piperidin-4-ylpropyl)piperidine
Molecular FormulaC13H26N2
Molecular Weight210.36
XLogP2.5
Topological Polar Surface Area24.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Heavy Atom Count15
Formal Charge0
Complexity140
SMILES
C1CNCCC1CCCC2CCNCC2
InChI
InChI=1S/C13H26N2/c1(2-12-4-8-14-9-5-12)3-13-6-10-15-11-7-13/h12-15H,1-11H2
InChIKey
OXEZLYIDQPBCBB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1,3-Bis(4-piperidinyl)propane
CAS: 16898-52-5
CID: 85631
Formula: C13H26N2
MW: 210.36
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight210.36
XLogP32.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass210.209598838
Monoisotopic Mass210.209598838
Topological Polar Surface Area24.1 Ų
Heavy Atom Count15
Formal Charge0
Complexity140
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
sc-2268294,4'-Trimethylenedipiperidine
PC64124,4,4-Trifluorobutyl 4,4,4-trifluorobutanoate
PC52154,4,4,4',4',4'-Hexafluorovaline hydrochloride
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PC4810-014,4,4,4',4',4'-Hexafluoro-DL-valine
PC450233-014,4,4,4',4',4'-Hexafluorovaline, ethyl ester
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