4-Nitrophenyl Hexanoate - ≥98%(GC) , CAS No.956-75-2

CAS: 956-75-2 Cat. No.: N159742 Formula: C12H15NO4 Peso molecolare: 237.26 Numero EC: 804-727-1
Disponibile su ordine
GRADE & PURITY ≥98%(GC)
Synonyms
InChI=1/C12H15NO4/c1-2-3-4-5-12(14)17-11-8-6-10(7-9-11)13(15)16/h6-9H,2-5H2,1H3 | N-CAPROICACID4-NITROPHENYLESTER | OLRXUEYZKCCEKK-UHFFFAOYSA-N | n-Caproic acid 4-nitrophenyl ester | SY045534 | DS-5450 | Hexanoic acid, 4-nitrophenyl ester | A858956 | 4-Ni
Storage
Store at 2-8°C
Shipped In
Wet ice
★
Size
Germania (EU)
USA*
Price
Qty
1g
N159742-1g
—
3 Disponibile
15,53€
5g
N159742-5g
—
3 Disponibile
38,96€
25g
N159742-25g
—
2 Disponibile
140,49€
Enter a quantity for the sizes you want to add.
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Why this grade

≥98%(GC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C 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.

📚

Literature proof

Cited in 6 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinonimi
InChI=1/C12H15NO4/c1-2-3-4-5-12(14)17-11-8-6-10(7-9-11)13(15)16/h6-9H,2-5H2,1H3 | N-CAPROICACID4-NITROPHENYLESTER | OLRXUEYZKCCEKK-UHFFFAOYSA-N | n-Caproic acid 4-nitrophenyl ester | SY045534 | DS-5450 | Hexanoic acid, 4-nitrophenyl ester | A858956 | 4-Ni
Specifiche e purezza
≥98%(GC)
Condizioni di conservazione di stoccaggio
Store at 2-8°C
Spedito in
Wet ice
Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.
Purezza
≥98%(GC)
Nomi e identificatori
Pubchem Sid
Sorrisi canonici
CCCCCC(=O)OC1=CC=C(C=C1)[N+](=O)[O-]
IUPAC Name
(4-nitrophenyl) hexanoate
InChIKey
OLRXUEYZKCCEKK-UHFFFAOYSA-N
INCHI
1S/C12H15NO4/c1-2-3-4-5-12(14)17-11-8-6-10(7-9-11)13(15)16/h6-9H,2-5H2,1H3
Isomeri SMILES
CCCCCC(=O)OC1=CC=C(C=C1)[N+](=O)[O-]
Peso molecolare
237.26
Reaxy-Rn
1914091
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1914091&ln=

Documentazione

📋 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
ClassePhenol esters
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentPhenol esters
Alternative Parents Nitrobenzenes  Phenoxy compounds  Nitroaromatic compounds  Fatty acid esters  Carboxylic acid esters  Propargyl-type 1,3-dipolar organic compounds  Organic oxoazanium compounds  Monocarboxylic acids and derivatives  Organopnictogen compounds  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Phenol ester - Nitrobenzene - Phenoxy compound - Nitroaromatic compound - Fatty acid ester - Monocyclic benzene moiety - Fatty acyl - Carboxylic acid ester - C-nitro compound - Organic nitro compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic oxoazanium - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organopnictogen compound - Aromatic homomonocyclic compound
DescrizioneThis compound belongs to the class of organic compounds known as phenol esters. These are aromatic compounds containing a benzene ring substituted by a hydroxyl group and an ester group.
External Descriptors a small molecule
Struttura 3D
Modello di struttura chimica interattiva





Meccanismi d'azione
Certificati (CoA, COO, BSE/TSE e tabella di analisi)
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.

6 results found

Lot NumberCertificate TypeDataOggetto
D2615062Certificate of AnalysisApr 21, 2026 N159742
I2216399Certificate of AnalysisAug 08, 2022 N159742
I2216467Certificate of AnalysisAug 08, 2022 N159742
C2221076Certificate of AnalysisMar 24, 2022 N159742
E1802036Certificate of AnalysisMar 08, 2022 N159742
E1802037Certificate of AnalysisMar 08, 2022 N159742
Proprietà chimiche e fisiche
SensibilitàAir Sensitive,Heat Sensitive
Indice di rifrazione1.52
Punto di ebollizione (°C)145 °C/1 mmHg
Peso molecolare237.250 g/mol
XLogP33.400
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Exact Mass237.1 Da
Monoisotopic Mass237.1 Da
Topological Polar Surface Area72.100 Ų
Heavy Atom Count17
Formal Charge0
Complexity254.000
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
Calcolatori di soluzioni
Recensioni

Recensioni dei clienti

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