N-Carbobenzoxyglycine 4-Nitrophenyl Ester - ≥98%(HPLC) , CAS No.1738-86-9

CAS: 1738-86-9 Cat. No.: N159588 Molecular Weight: 330.3 EC Number: 217-097-2
AVAILABLE TO ORDER
GRADE & PURITY ≥98%(HPLC)
Synonyms
Carbobenzoxyglycine p-nitrophenyl ester | DTXSID30169659 | Glycine, N-((phenylmethoxy)carbonyl)-, 4-nitrophenyl ester | AKOS016003463 | GLYCINE, N-CARBOXY-, N-BENZYL ESTER, p-NITROPHENYL ESTER | 4-Nitrophenyl ([(benzyloxy)carbonyl]amino)acetate # | NSC405
Storage
Room temperature
Shipped In
Normal
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Size
Status
Price
Qty
200mg
N159588-200mg
4
$22.90
1g
N159588-1g
3
$87.90
Enter a quantity for the sizes you want to add.
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Why this grade

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

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Storage & shipping

Room temperature Ships Normal Check lot-specific COA for exact specifications.

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

Specifications

Synonyms
Carbobenzoxyglycine p-nitrophenyl ester | DTXSID30169659 | Glycine, N-((phenylmethoxy)carbonyl)-, 4-nitrophenyl ester | AKOS016003463 | GLYCINE, N-CARBOXY-, N-BENZYL ESTER, p-NITROPHENYL ESTER | 4-Nitrophenyl ([(benzyloxy)carbonyl]amino)acetate # | NSC405
Specifications & Purity
≥98%(HPLC)
Storage
Room temperature
Shipped In
Normal
Purity
≥98%(HPLC)
Names and Identifiers
Pubchem Sid504752685
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504752685
Canonical SmilesC1=CC=C(C=C1)COC(=O)NCC(=O)OC2=CC=C(C=C2)[N+](=O)[O-]
IUPAC Name(4-nitrophenyl) 2-(phenylmethoxycarbonylamino)acetate
InChIKeyLHFNPUGRSYOPLF-UHFFFAOYSA-N
INCHI1S/C16H14N2O6/c19-15(24-14-8-6-13(7-9-14)18(21)22)10-17-16(20)23-11-12-4-2-1-3-5-12/h1-9H,10-11H2,(H,17,20)
Isomeric SMILES C1=CC=C(C=C1)COC(=O)NCC(=O)OC2=CC=C(C=C2)[N+](=O)[O-]
RTECS MB9139000
Molecular Weight 330.3
Reaxy-Rn 1916980
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1916980&ln=

Documentation

📋 Safety Data Sheet (SDS)

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

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✅ Certificate of Analysis (COA)

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

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📊 Datasheet

Quick-reference summary of product specifications and applications.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

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Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganic acids and derivatives
ClassCarboxylic acids and derivatives
SubclassAmino acids, peptides, and analogues
Intermediate Tree Nodes Amino acids and derivatives - Alpha amino acids and derivatives
Direct ParentAlpha amino acid esters
Alternative Parents Phenol esters  Benzyloxycarbonyls  Nitrobenzenes  Phenoxy compounds  Nitroaromatic compounds  Carbamate esters  Carboxylic acid esters  Organic carbonic acids and derivatives  Propargyl-type 1,3-dipolar organic compounds  Organic oxoazanium compounds  Monocarboxylic acids and derivatives  Hydrocarbon derivatives  Organic oxides  Carbonyl compounds  Organonitrogen compounds  Organopnictogen compounds  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Alpha-amino acid ester - Benzyloxycarbonyl - Phenol ester - Nitrobenzene - Phenoxy compound - Nitroaromatic compound - Monocyclic benzene moiety - Benzenoid - Carbamic acid ester - Carboxylic acid ester - C-nitro compound - Carbonic acid derivative - Organic nitro compound - Organic oxoazanium - Monocarboxylic acid or derivatives - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Carbonyl group - Organopnictogen compound - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(non-human)
Papain (844 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.

2 results found

Lot NumberCertificate TypeDateItem
K2202697Certificate of AnalysisSep 29, 2022 N159588
K2202782Certificate of AnalysisSep 29, 2022 N159588
Chemical and Physical Properties
SensitivityLight Sensitive
Melt Point(°C)128 °C
Molecular Weight330.290 g/mol
XLogP32.700
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Exact Mass330.085 Da
Monoisotopic Mass330.085 Da
Topological Polar Surface Area110.000 Ų
Heavy Atom Count24
Formal Charge0
Complexity436.000
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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