3-Nitro-L-phenylalanine - ≥98% , CAS No.19883-74-0

CAS: 19883-74-0 Cat. No.: L302694 Molecular Weight: 210.19 EC Number: 897-926-8
AVAILABLE TO ORDER
GRADE & PURITY ≥98%
Synonyms
SCHEMBL44005 | L-Phenylalanine, 3-nitro- | (S)-2-amino-3-(3-nitrophenyl)propanoic acid | AM83445 | NSC-21948 | AC-7951 | (S)-2-Amino-3-(3-nitrophenyl)propanoicacid | J-012842 | DTXSID601313707 | NCGC00096399-01 | H-Phe(3-NO2)-OH | L-3-Nitrophe | NCIStruc1
Storage
Room temperature,Desiccated
Shipped In
Normal
Size
Status
Price
Qty
1g
L302694-1g
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5g
L302694-5g
2

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Why this grade

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

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Storage & shipping

Room temperature,Desiccated 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
SCHEMBL44005 | L-Phenylalanine, 3-nitro- | (S)-2-amino-3-(3-nitrophenyl)propanoic acid | AM83445 | NSC-21948 | AC-7951 | (S)-2-Amino-3-(3-nitrophenyl)propanoicacid | J-012842 | DTXSID601313707 | NCGC00096399-01 | H-Phe(3-NO2)-OH | L-3-Nitrophe | NCIStruc1
Specifications & Purity
≥98%
Storage
Room temperature, Desiccated
Shipped In
Normal
Purity
≥98%
Names and Identifiers
Pubchem Sid504761658
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504761658
Canonical SmilesC1=CC(=CC(=C1)[N+](=O)[O-])CC(C(=O)O)N
IUPAC Name(2S)-2-amino-3-(3-nitrophenyl)propanoic acid
InChIKeyYTHDRUZHNYKZGF-QMMMGPOBSA-N
INCHI1S/C9H10N2O4/c10-8(9(12)13)5-6-2-1-3-7(4-6)11(14)15/h1-4,8H,5,10H2,(H,12,13)/t8-/m0/s1
Isomeric SMILES C1=CC(=CC(=C1)[N+](=O)[O-])C[C@@H](C(=O)O)N
Molecular Weight 210.19
Reaxy-Rn 2127361
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2127361&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 ParentPhenylalanine and derivatives
Alternative Parents Phenylpropanoic acids  Amphetamines and derivatives  L-alpha-amino acids  Nitrobenzenes  Nitroaromatic compounds  Aralkylamines  Amino acids  Propargyl-type 1,3-dipolar organic compounds  Carboxylic acids  Organic oxoazanium compounds  Monocarboxylic acids and derivatives  Hydrocarbon derivatives  Organopnictogen compounds  Organic zwitterions  Monoalkylamines  Carbonyl compounds  Organic oxides  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Phenylalanine or derivatives - 3-phenylpropanoic-acid - Alpha-amino acid - Amphetamine or derivatives - L-alpha-amino acid - Nitrobenzene - Nitroaromatic compound - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Amino acid - C-nitro compound - Organic nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Carboxylic acid - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Primary amine - Organic zwitterion - Hydrocarbon derivative - Primary aliphatic amine - Organic oxide - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Amine - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as phenylalanine and derivatives. These are compounds containing phenylalanine or a derivative thereof resulting from reaction of phenylalanine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
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
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
H2125323Certificate of AnalysisJun 18, 2024 L302694
H2125324Certificate of AnalysisJun 18, 2024 L302694
Chemical and Physical Properties
Flash Point(°C)202.3ºC
Boil Point(°C)410.8ºC
Melt Point(°C)256-258ºC
Molecular Weight210.190 g/mol
XLogP3-1.200
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass210.064 Da
Monoisotopic Mass210.064 Da
Topological Polar Surface Area109.000 Ų
Heavy Atom Count15
Formal Charge0
Complexity251.000
Isotope Atom Count0
Defined Atom Stereocenter Count1
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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