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Basic Description
| Synonyms | B0711 | ?N-Phenyl-n-butylamine | BAA12678 | n-Butyl-N-phenylamine | n-Butyl-N-phenylamine # | butylaniline | UNII-R2ZNJ7L2UM | WLN: 4MR | Benzenamine, N-butyl- | NSC7114 | NSC-7114 | EINECS 214-425-6 | UN2738 | UN-2738 | n-Butyl aniline | Benzamine, N-but |
|---|---|
| Specifications & Purity | ≥98%(GC) |
| Storage Temp | Argon charged |
| Shipped In | Normal |
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic nitrogen compounds
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Class
Organonitrogen compounds
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Subclass
Amines
- Level5 Aralkylamines
- Level6 Phenylalkylamines
- Level5 Aralkylamines
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Subclass
Amines
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Class
Organonitrogen compounds
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Superclass
Organic nitrogen compounds
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organic nitrogen compounds |
| Class | Organonitrogen compounds |
| Subclass | Amines |
| Intermediate Tree Nodes | Aralkylamines |
| Direct Parent | Phenylalkylamines |
| Alternative Parents | Aniline and substituted anilines Secondary alkylarylamines Organopnictogen compounds Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Phenylalkylamine - Aniline or substituted anilines - Secondary aliphatic/aromatic amine - Benzenoid - Monocyclic benzene moiety - Secondary amine - Organopnictogen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as phenylalkylamines. These are organic amines where the amine group is secondary and linked on one end to a phenyl group and on the other end, to an alkyl group. |
| External Descriptors | Not available |
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Names and Identifiers
| Pubchem Sid | 488181973 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488181973 |
| IUPAC Name | N-butylaniline |
| INCHI | InChI=1S/C10H15N/c1-2-3-9-11-10-7-5-4-6-8-10/h4-8,11H,2-3,9H2,1H3 |
| InChIKey | VSHTWPWTCXQLQN-UHFFFAOYSA-N |
| Smiles | CCCCNC1=CC=CC=C1 |
| Isomeric SMILES | CCCCNC1=CC=CC=C1 |
| WGK Germany | 3 |
| RTECS | BW9450000 |
| UN Number | 2738 |
| Packing Group | II |
| Molecular Weight | 149.23 |
| Beilstein | 12(3)267 |
| Reaxy-Rn | 2206226 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2206226&ln= |
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 G2113087 |
Certificate of Analysis | Apr 08, 2025 | B140175 |
| G2410558 |
Certificate of Analysis | Apr 28, 2024 | B140175 |
| G2410574 |
Certificate of Analysis | Apr 28, 2024 | B140175 |
| G2410584 |
Certificate of Analysis | Apr 28, 2024 | B140175 |
| E1625038 |
Certificate of Analysis | Jan 03, 2024 | B140175 |
| G2319306 |
Certificate of Analysis | Jun 12, 2023 | B140175 |
| G2319321 |
Certificate of Analysis | Jun 12, 2023 | B140175 |
| G2319324 |
Certificate of Analysis | Jun 12, 2023 | B140175 |
| G2319319 |
Certificate of Analysis | Jun 12, 2023 | B140175 |
| G2319318 |
Certificate of Analysis | Jun 12, 2023 | B140175 |
| G2319315 |
Certificate of Analysis | Jun 12, 2023 | B140175 |
| G2319331 |
Certificate of Analysis | Jun 12, 2023 | B140175 |
| G2319326 |
Certificate of Analysis | Jun 12, 2023 | B140175 |
| K2208078 |
Certificate of Analysis | Nov 09, 2022 | B140175 |
| F23171141 |
Certificate of Analysis | Nov 09, 2022 | B140175 |
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Chemical and Physical Properties
| Solubility | Insoluble in water; Soluble in Alcohol,Benzene,Ether |
|---|---|
| Sensitivity | Air Sensitive |
| Refractive Index | 1.5320-1.5350 |
| Flash Point(°F) | 222.8 °F |
| Flash Point(°C) | 106 °C |
| Boil Point(°C) | 240°C |
| Melt Point(°C) | -14.4°C |
| Molecular Weight | 149.230 g/mol |
| XLogP3 | 2.800 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 4 |
| Exact Mass | 149.12 Da |
| Monoisotopic Mass | 149.12 Da |
| Topological Polar Surface Area | 12.000 Ų |
| Heavy Atom Count | 11 |
| Formal Charge | 0 |
| Complexity | 84.900 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
Alternative Products
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N-ButylanilineStarting at $16.90
Citations of This Product
| 1. Wenfeng Zhao, Xiaoping Chi, Hu Li, Jian He, Jingxuan Long, Yufei Xu, Song Yang. (2019) Eco-friendly acetylcholine-carboxylate bio-ionic liquids for controllable N-methylation and N-formylation using ambient CO2 at low temperatures. GREEN CHEMISTRY, 21 (3): (567-577). |
| 2. Kaineng Huang, Yi He, Xingyu Li, Yuanjiang Pan, Yuanji Gao. (2024) Unlocking the Mysteries of the Desorption–Ionization Mechanism via Separate Thermal and Charge Strategies. ANALYTICAL CHEMISTRY, 96 (48): (19012-19020). |
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