Tridodecylmethylammonium chloride
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Basic information
- CAS
7173-54-8- Standard SMILES
CCCCCCCCCCCC[N+](C)(CCCCCCCCCCCC)CCCCCCCCCCCC.[Cl-]- InChIKey
SBHRWOBHKASWGU-UHFFFAOYSA-M- Molecular formula
- C37H78ClN
- Average molar mass
- 572.5 g/mol
- Monoisotopic mass
- 571.5822792
Overview
quaternary amine which forms molecular bond with heparin & can attach firmly to a polyvinyl chloride surface for a nonthrombogenic bypass cannula; RN given refers to chloride
Names & identifiers
- Preferred name
- Tridodecylmethylammonium chloride
- IUPAC
- tridodecyl(methyl)azanium chloride
- English name
- Tridodecyl methyl ammonium chloride
- Molecular formula
- C37H78ClN
- Molecular weight
- 572.47
Names & synonyms
7173-54-8Tridodecylmethylammonium chlorideTridodecylmethylammoniumDTXSID808843601-Dodecanaminium, N,N-didodecyl-N-methyl-, chloride (1:1)TDMACRefChem:899431DTXCID401023805615-335-3Methyltridodecylammonium chlorideTridodecyl methyl ammonium chlorideN,N-Didodecyl-N-methyldodecan-1-aminium chloride
Show more names
TDDMACMethyltridodecylaminiumTridodecylmethylaminiumMethyltrisdodecylaminiumTridodecyl(methyl)aminiumTRIDODECYMETHYLAMMONIUMCHLORIDEMethyltridodecylaminium·chloride
tridodecyl(methyl)azanium chloride1-Dodecanaminium, N,N-didodecyl-N-methyl-, chloridetridodecyl(methyl)azanium;chloride1-Dodecanaminium,N,N-didodecyl-N-methyl-, chloride (1:1)MFCD00043303C37H78ClNSCHEMBL220293orb2942255
Database identifiers
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 33
- Heavy atoms
- 39
- Formal charge
- 0
- Complexity
- 357
Physicochemical properties
- Melting point
- 110 · 110-112 °C(lit.)
- storage temp.
- -20 °C, · -20°C, sealed storage, away from moisture and light
- form
- Solid
- color
- White to off-white
- BRN
- 6031445 · 6031445
- InChI
- 1S/C37H78N.ClH/c1-5-8-11-14-17-20-23-26-29-32-35-38(4,36-33-30-27-24-21-18-15-12-9-6-2)37-34-31-28-25-22-19-16-13-10-7-3;/h5-37H2,1-4H3;1H/q+1;/p-1
- InChIKey
- SBHRWOBHKASWGU-UHFFFAOYSA-M
- SMILES
- [Cl-].CCCCCCCCCCCC[N+](C)(CCCCCCCCCCCC)CCCCCCCCCCCC
- CAS DataBase Reference
- 7173 · 7173-54-8(CAS DataBase Reference)
- EPA Substance Registry System
- 1 · 1-Dodecanaminium, N,N-didodecyl-N-methyl-, chloride (7173-54-8)
- UNSPSC Code
- 26111700 · 26111700
- NACRES
- 61 · NB.61
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 41 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- F
- 3-10
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- tsca
- TSCA listed
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36
- Storage Class
- 11 - Combustible Solids
- 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
Uses & manufacturing
General Manufacturing Information1-Dodecanaminium, N,N-didodecyl-N-methyl-, chloride (1:1): ACTIVE
Applications
UsesSelected application examples
UsesChloride doping agent used to prepare multi-gate ion-sensitive field-effect transistors.
General DescriptionVisit our Sensor Applications portal to learn more.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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