N-(4-Chlorobenzoyl)Tyramine - ≥98%(HPLC) , CAS No.41859-57-8

CAS: 41859-57-8 Cat. No.: N133336 Molecular Weight: 275.73 EC Number: 255-566-3
AVAILABLE TO ORDER
GRADE & PURITY ≥98%(HPLC)
Synonyms
Tox21_300684 | Oprea1_126724 | Q63396588 | Bezafibrate EP Impurity A | N-(4-Chlorobenzoyl)tyramine | N-(4-Chlorobenzoyl)-tyramine | A825676 | C2309 | Benzamide, 4-chloro-N-(2-(4-hydroxyphenyl)ethyl)- | SMR000145393 | 4-Chloro-N-[2-(4-hydroxyphenyl)ethyl]b
Storage
Argon charged,Room temperature
Shipped In
Normal
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Size
Status
Price
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1g
N133336-1g
1

$11.90

$17.90
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5g
N133336-5g
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$42.90

$64.90
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25g
N133336-25g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

$157.90

$236.90
Save $79.00 (33.35%)
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Why this grade

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

🌡

Storage & shipping

Argon charged,Room temperature Ships Normal 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.

Specifications

Synonyms
Tox21_300684 | Oprea1_126724 | Q63396588 | Bezafibrate EP Impurity A | N-(4-Chlorobenzoyl)tyramine | N-(4-Chlorobenzoyl)-tyramine | A825676 | C2309 | Benzamide, 4-chloro-N-(2-(4-hydroxyphenyl)ethyl)- | SMR000145393 | 4-Chloro-N-[2-(4-hydroxyphenyl)ethyl]b
Specifications & Purity
≥98%(HPLC)
Storage
Argon charged, Room temperature
Shipped In
Normal
Purity
≥98%(HPLC)
Names and Identifiers
Pubchem Sid504757804
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504757804
Canonical SmilesC1=CC(=CC=C1CCNC(=O)C2=CC=C(C=C2)Cl)O
IUPAC Name4-chloro-N-[2-(4-hydroxyphenyl)ethyl]benzamide
InChIKeyZTLWJYCDAXUIBK-UHFFFAOYSA-N
INCHI1S/C15H14ClNO2/c16-13-5-3-12(4-6-13)15(19)17-10-9-11-1-7-14(18)8-2-11/h1-8,18H,9-10H2,(H,17,19)
Isomeric SMILES C1=CC(=CC=C1CCNC(=O)C2=CC=C(C=C2)Cl)O
RTECS CV2450481
Molecular Weight 275.73
Reaxy-Rn 2135000
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2135000&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
SubclassBenzoic acids and derivatives
Intermediate Tree Nodes Halobenzoic acids and derivatives
Direct Parent4-halobenzoic acids and derivatives
Alternative Parents Benzamides  Benzoyl derivatives  Chlorobenzenes  1-hydroxy-2-unsubstituted benzenoids  Aryl chlorides  Secondary carboxylic acid amides  Organopnictogen compounds  Organooxygen compounds  Organonitrogen compounds  Organochlorides  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents 4-halobenzoic acid or derivatives - Benzamide - Benzoyl - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as 4-halobenzoic acids and derivatives. These are benzoic acids or derivatives carrying a halogen atom at the 4-position of the benzene ring.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
GAA Tclin Lysosomal alpha-glucosidase (35701 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CYP2D6 Tclin Cytochrome P450 2D6 (33882 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CYP1A2 Tchem Cytochrome P450 1A2 (26471 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CYP2C9 Tchem Cytochrome P450 2C9 (32119 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CYP2C19 Tchem Cytochrome P450 2C19 (29246 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CYP3A4 Tclin Cytochrome P450 3A4 (53859 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HeLa (62764 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
GLI1 Tchem Zinc finger protein GLI1 (201 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
BRCA1 Tchem Breast cancer type 1 susceptibility protein (15908 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
SMN1 Tchem Survival motor neuron protein (34246 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
NPC1 Tchem Niemann-Pick C1 protein (18985 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
RAB9A Tbio Ras-related protein Rab-9A (22488 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
microRNA 21 (64692 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
GFER Tchem FAD-linked sulfhydryl oxidase ALR (1466 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
ATAD5 Tbio ATPase family AAA domain-containing protein 5 (122566 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Associated Targets(non-human)
Plasmodium falciparum (966862 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Luciferin 4-monooxygenase (66902 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mapt Microtubule-associated protein tau (6 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Nfe2l2 Nuclear factor erythroid 2-related factor 2 (214 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Rorc Nuclear receptor ROR-gamma (89407 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mechanisms of Action
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.

4 results found

Lot NumberCertificate TypeDateItem
J2318844Certificate of AnalysisAug 07, 2025 N133336
J2318845Certificate of AnalysisAug 07, 2025 N133336
J2318870Certificate of AnalysisAug 07, 2025 N133336
J2318872Certificate of AnalysisSep 26, 2023 N133336
Chemical and Physical Properties
SensitivityAir Sensitive
Melt Point(°C)174 °C
Molecular Weight275.730 g/mol
XLogP33.400
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass275.071 Da
Monoisotopic Mass275.071 Da
Topological Polar Surface Area49.300 Ų
Heavy Atom Count19
Formal Charge0
Complexity282.000
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
Solution Calculators
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