4-n-Octylaniline - ≥97% , CAS No.16245-79-7

CAS: 16245-79-7 Cat. No.: N159443 Molecular Weight: 205.35 Beilstein Registry Number: 121185 EC Number: 240-358-7
AVAILABLE TO ORDER
GRADE & PURITY ≥97%
Synonyms
F0001-0584 | 5(4H)-Oxazolone, 4-[(2-bromophenyl)methylene]-2-methyl- | SB78179 | AKOS015839936 | H-D-Asn-OH.H2O | SCHEMBL111952 | SY052531 | 5,24-Cholestadien-3beta-ol | O9FN212WZZ | p-Octylaniline | 4-Octylaniline | 4-Octylphenylamine | 4-(n-octyl)anilin
Storage
Store at 2-8°C,Argon charged
Shipped In
Wet ice
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
1g
N159443-1g
10

$9.90

$14.90
Save $5.00 (33.56%)
5g
N159443-5g
5

$34.90

$52.90
Save $18.00 (34.03%)
25g
N159443-25g
5

$130.90

$196.90
Save $66.00 (33.52%)
100g
N159443-100g
2

$458.90

$688.90
Save $230.00 (33.39%)
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Why this grade

≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C,Argon charged Ships Wet ice Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Overview

Micrometer-sized oil droplet of 4-octylaniline containing 5 mol% of an amphiphilic catalyst exhibits a self-propelled motion, producing tiny oil droplets. Kinetics of proton transfer facilitated by 4-octylaniline across the water/1,2-dichloroethane interface has been investigated by cyclic voltammetry and ac impedance.
4-Octylaniline has been used as an extractant during the extraction of microgram level concentrations of ruthenium(IV) from halide medium. It has also been used in the synthesis of selective benzimidazole based analogs of sphingosine-1-phosphate.

Specifications

Synonyms
F0001-0584 | 5(4H)-Oxazolone, 4-[(2-bromophenyl)methylene]-2-methyl- | SB78179 | AKOS015839936 | H-D-Asn-OH.H2O | SCHEMBL111952 | SY052531 | 5, 24-Cholestadien-3beta-ol | O9FN212WZZ | p-Octylaniline | 4-Octylaniline | 4-Octylphenylamine | 4-(n-octyl)anilin
Specifications & Purity
≥97%
Storage
Store at 2-8°C, Argon charged
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Purity
≥97%
Names and Identifiers
Pubchem Sid488186315
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488186315
Canonical SmilesCCCCCCCCC1=CC=C(C=C1)N
IUPAC Name4-octylaniline
InChIKeyORKQJTBYQZITLA-UHFFFAOYSA-N
INCHI1S/C14H23N/c1-2-3-4-5-6-7-8-13-9-11-14(15)12-10-13/h9-12H,2-8,15H2,1H3
Isomeric SMILES CCCCCCCCC1=CC=C(C=C1)N
WGK Germany 3
Molecular Weight 205.35
Beilstein 121185
Reaxy-Rn 2936963
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2936963&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClassBenzene and substituted derivatives
SubclassAniline and substituted anilines
Intermediate Tree Nodes Not available
Direct ParentAniline and substituted anilines
Alternative Parents Primary amines  Organopnictogen compounds  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Aniline or substituted anilines - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Amine - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as aniline and substituted anilines. These are organic compounds containing an aminobenzene moiety.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





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.

16 results found

Lot NumberCertificate TypeDateItem
G1809138Certificate of AnalysisFeb 05, 2026 N159443
B2226664Certificate of AnalysisJan 04, 2026 N159443
B2226702Certificate of AnalysisJan 04, 2026 N159443
E2112103Certificate of AnalysisFeb 07, 2025 N159443
E2112106Certificate of AnalysisFeb 07, 2025 N159443
L2417768Certificate of AnalysisJun 11, 2024 N159443
F23271086Certificate of AnalysisMay 19, 2023 N159443
F23271087Certificate of AnalysisMay 19, 2023 N159443
F23271089Certificate of AnalysisMay 19, 2023 N159443
F23271090Certificate of AnalysisMay 19, 2023 N159443
F23271091Certificate of AnalysisMay 19, 2023 N159443
F23271093Certificate of AnalysisMay 19, 2023 N159443
K2518083Certificate of AnalysisMay 19, 2023 N159443
K2519029Certificate of AnalysisMay 19, 2023 N159443
B2226701Certificate of AnalysisJan 19, 2022 N159443
D2323777Certificate of AnalysisJan 19, 2022 N159443

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Chemical and Physical Properties
SolubilityInsoluble in water.
SensitivityAir Sensitive
Refractive Index1.52
Flash Point(°F)235.4 °F
Flash Point(°C)113 °C
Boil Point(°C)311°C(lit.)
Melt Point(°C)17 °C
Molecular Weight205.340 g/mol
XLogP35.000
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count7
Exact Mass205.183 Da
Monoisotopic Mass205.183 Da
Topological Polar Surface Area26.000 Ų
Heavy Atom Count15
Formal Charge0
Complexity136.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Citations of This Product
References
1. Yi Hao, Yuan Gao, Luyao Gao, Yulian He, Yingying Niu, Sameer Hussain, Ruixia Gao, Lisa D. Pfefferle, M. Shahid, Sicen Wang.  (2021)  Amphiphilic core–shell magnetic adsorbents for efficient removal and detection of phthalate esters.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2021.129817]
Solution Calculators
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