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224,000+ 研究の概要 · Triple ISO certified · COA & SDS すべての製品に適用 · 在庫品は当日出荷

Terfenadone , CAS No.43076-30-8

Name: Terfenadone , CAS No.43076-30-8
SKU: T345258
Availability: InStock

CAS: 43076-30-8 Cat. No.: T345258 分子式: C₃₂H₃₉NO₂ 分子量: 469.66 PubChem CID: 39380

COA

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Terfenadone - CAS No(43076-30-8) by Aladdin Scientific

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注文可能

Synonyms

1-[4-(1,1-Dimethylethyl)phenyl]-4-[4-(hydroxydiphenylmethyl)piperidin-1-yl]butan-1-one; Terfenadine Imp. A (EP); Terfenadone; Terfenadine Related Compound A; Terfenadine Impurity A | 1-Butanone, 1-(4-(1,1-dimethylethyl)phenyl)-4-(4-(hydroxydiphenylmethyl)

Storage

Store at 2-8°C

Shipped In

Wet ice

概要 Specifications 名前と識別子 Documentation Advanced Data Taxonomic Classification 3 D構造関連ターゲット（人間）関連ターゲット（非人間）作用メカニズム証明書（CoA、COO、BSE/TSEと分析図）化学的性質と物理的性質ソリューション計算機レビュー

🧪

Why this grade

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 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

概要

Terfenadone is a compound with potential antihistamine properties in vitro. It has also been seen in vitro to inhibitor human cells from having the CD81-receptor HCV-E2 interaction. It acts similar to Benzyl Salicylate .

Specifications

同義語

保管条件

Store at 2-8°C

入荷

Wet ice

この製品は冷冷この冷このこの製品の運送が必要です。地上およびその他の経済サービスは利用できません。

名前と識別子

カノニカル・スマイル	CC(C)(C)C1=CC=C(C=C1)C(=O)CCCN2CCC(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O
IUPAC Name	1-(4-tert-butylphenyl)-4-[4-[hydroxy(diphenyl)methyl]piperidin-1-yl]butan-1-one
InChIKey	YCADFOXVGUGHRV-UHFFFAOYSA-N
INCHI	1S/C32H39NO2/c1-31(2,3)26-18-16-25(17-19-26)30(34)15-10-22-33-23-20-29(21-24-33)32(35,27-11-6-4-7-12-27)28-13-8-5-9-14-28/h4-9,11-14,16-19,29,35H,10,15,20-24H2,1-3H3
異性体SMILES	CC(C)(C)C1=CC=C(C=C1)C(=O)CCCN2CCC(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O
PubChem CID	39380
分子量	469.66

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

Kingdom Organic compounds
- Superclass Benzenoids
  - 分類 Benzene and substituted derivatives
    - Subclass Diphenylmethanes

Kingdom	Organic compounds
Superclass	Benzenoids
分類	Benzene and substituted derivatives
Subclass	Diphenylmethanes
Intermediate Tree Nodes	Not available
Direct Parent	Diphenylmethanes
Alternative Parents	Alkyl-phenylketones Phenylbutylamines Butyrophenones Phenylpropanes Aryl alkyl ketones Benzoyl derivatives Aralkylamines Piperidines Gamma-amino ketones Tertiary alcohols Trialkylamines Azacyclic compounds Hydrocarbon derivatives Aromatic alcohols Organic oxides Organopnictogen compounds
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Diphenylmethane - Alkyl-phenylketone - Butyrophenone - Phenylbutylamine - Phenylketone - Phenylpropane - Benzoyl - Aryl alkyl ketone - Aryl ketone - Aralkylamine - Gamma-aminoketone - Piperidine - Tertiary alcohol - Ketone - Tertiary amine - Tertiary aliphatic amine - Organoheterocyclic compound - Azacycle - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Alcohol - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic alcohol - Amine - Aromatic heteromonocyclic compound
説明	This compound belongs to the class of organic compounds known as diphenylmethanes. These are compounds containing a diphenylmethane moiety, which consists of a methane wherein two hydrogen atoms are replaced by two phenyl groups.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

3 D構造

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レビュー

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融点（°C）	106-138° C
分子量	469.700 g/mol
XLogP3	6.700
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	9
Exact Mass	469.298 Da
Monoisotopic Mass	469.298 Da
Topological Polar Surface Area	40.500 Å²
Heavy Atom Count	35
Formal Charge	0
Complexity	621.000
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