Tridecanamine
Basic information
- CAS
2869-34-3- Standard SMILES
CCCCCCCCCCCCCN- InChIKey
ABVVEAHYODGCLZ-UHFFFAOYSA-N- Molecular formula
- C13H29N
- Average molar mass
- 199.38 g/mol
- Monoisotopic mass
- 199.22999993
Names & identifiers
- Preferred name
- Tridecanamine
- IUPAC
- tridecan-1-amine
- English name
- 1-Aminotridecane
- Molecular formula
- C13H29N
- Molecular weight
- 199.38
Names & synonyms
1-AminotridecaneTridecylamine1-Tridecanamine2869-34-3tridecan-1-aminen-TridecylamineTridecanamineMonotridecylamine1-TridecylamineBRN 17399905S0KQ9WZ2DEINECS 220-694-0
Show more names
AMINE C13TrideamineTridecylaminn-Tridecylamin1-TridecanaminN-TRYDECYLAMINE
TRIDECANAMINE [WHO-DD]DTXSID0022199nTridecylamine1Aminotridecane1Tridecanamine1TridecylamineRefChem:899390DTXCID702199
Database identifiers
- CAS
2869-34-3- PubChem CID
- 40761
- DTXSID
DTXSID0022199- ChEMBL
CHEMBL4091277- UNII
- 5S0KQ9WZ2D
- EC Number
- 220-694-0
- Nikkaji
- J161I
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 11
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 91.2
Experimental & physicochemical properties
Chemical ClassesNitrogen Compounds -> Amines, Aliphatic
SpringerMaterials PropertiesBoiling point
Physical DescriptionWhite solid or liquid; mp = 26-30 deg C; [Acros Organics MSDS]
Physicochemical properties
- Melting point
- 30 · 30-32 °C(lit.)
- Boiling point
- 265 °C · 265 °C(lit.)
- Density
- 0 · 0,818 g/cm3
- refractive index
- 1.4443 · 1.4443
- Flash point
- 230 °F · >230 °F
- storage temp.
- 2 · 2-8°C, protect from light
- pka
- 10.63 · 10.63(at 25℃)
- form
- powder to lump to clear liquid
- color
- White or Colorless to Light yellow
- BRN
- 1739990 · 1739990
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
Danger
H302 (24.7%): Harmful if swallowed [Warning Acute toxicity, oral]
P260, P264, P264+P265, P270, P273, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P321, P330, P332+P317, P337+P317, P362+P364, P363, P391, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 586 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazards SummaryIntraperitoneal LD50 (mouse) = 70 mg/kg; [RTECS] Causes burns; Inhalation may cause corrosive injuries to the respiratory tract; Harmful by ingestion; [Acros Organics MSDS] See Hexadecylamine, Octadecylamine, and Pentadecylamine.
Hazard Classes and CategoriesAcute Tox. 4 (24.7%)
Toxicology
Adverse EffectsDermatotoxin - Skin burns.
Safety data
- PPE
- Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges
- wgk
- 3
- tsca
- TSCA listed
- rtecs
- YD3011650
- ridadr
- UN 3082 9/PG 3
- hs_code
- 2921199990
- risk_code
- 22-37/38-41-50/53-34
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1-Tridecanamine: ACTIVE
Applications
UsesTridecylamine is generally used in introducing C13 chain to the substrate. Some of the application are:Synthesis of alkylated 1,2,4-triazoles as bridging ligand in the preparation of polymeric 1-dimensional chains of iron(II) species.Synthesis of amphiphiles such as N-tridecyl-β-hydroxypropionic acid amide (THPA) and N-(β-hydroxyethyl)tridecanoic acid amide (HETA).As a ligand in the preparation of palladium-based catalyst, [PdCl2(TDA)2].
Upstream & downstream products
Downstream products
Suppliers
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Related reactions
2 records
Compound notes
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