Basic information
- CAS
91323-12-5- Standard SMILES
CCCCCCCCCCCCCCc1ccc(N)cc1- InChIKey
WKYFQPQIOXXPGE-UHFFFAOYSA-N- Molecular formula
- C20H35N
- Average molar mass
- 289.5 g/mol
- Monoisotopic mass
- 289.27695012
Names & identifiers
- Preferred name
- p-Tetradecylaniline
- IUPAC
- 4-tetradecylaniline
- English name
- 4-Tetradecylaniline
- Molecular formula
- C20H35N
- Molecular weight
- 289.5
Names & synonyms
91323-12-5p-TetradecylanilineDTXSID50238518RefChem:169387DTXCID00161009WKYFQPQIOXXPGE-UHFFFAOYSA-N4-Tetradecylaniline(4-tetradecylphenyl)amine4-n-TetradecylanilinMFCD000098044-tetradecylphenylamine4-n-tetradecylaniline
Show more names
4-Tertrdecyl anilineBenzenamine, 4-tetradecyl-
4-Tetradecylanitine4-Tetradecylaniline #4-Tetradecylaniline, 97%SCHEMBL1164527TIMTEC-BB SBB0079384-TETRADECYLANILINE 97%C20H35NALBB-023973
Database identifiers
- CAS
91323-12-5- PubChem CID
- 145224
- DTXSID
DTXSID50238518- EC Number
- 629-156-3
- Nikkaji
- J236.414J
Properties
Computed structural properties
- XLogP
- 8.3
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 13
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 206
Physicochemical properties
- Melting point
- 46 · 46-49 °C (lit.)
- Boiling point
- 408 · 408.0±14.0 °C(Predicted)
- Density
- 0.897 · 0.897±0.06 g/cm3(Predicted)
- Flash point
- 230 °F · >230 °F
- pka
- 4.95 · 4.95±0.10(Predicted)
- form
- solid
- InChI
- 1S/C20H35N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-19-15-17-20(21)18-16-19/h15-18H,2-14,21H2,1H3
- InChIKey
- WKYFQPQIOXXPGE-UHFFFAOYSA-N
- SMILES
- CCCCCCCCCCCCCCc1ccc(N)cc1
- 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
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 39 reports by companies from 2 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
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36/37/39
- 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
Applications
Uses4-Tetradecylaniline has been used:as standard during the quantitative determination of trans content of fats and oils and margarine by FTIR spectroscopyto investigate the quenching of the triplet state of n-alkyl 3-nitrophenyl ethers in aqueous micellar sodium dodecyl sulfate (SDS) solutions by laser flash photolysisin amidation and esterification of oxidised single-walled carbon nanotubes (SWCNTs)
Suppliers45 total
南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
郑州汇聚化工有限公司13393710386 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Aladdin Scientific[email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
广东方信生物科技有限公司0751-2838688 13376594225 · [email protected]
Related reactions
8 records
Compound notes
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