6-Aminouracil - ≥98% , CAS No.873-83-6

CAS: 873-83-6 Cat. No.: A107382 Summenformel: C₄H₅N₃O₂ Molekulargewicht: 127.1 Beilstein Registry Number: 120491 EG-Nummer: 212-854-3

GRADE & PURITY ≥98%

Synonyms

6-Amino-1H-pyrimidine-2,4-dione | FT-0660294 | EINECS 212-854-3 | 6-Aminouracil, 97% | EN300-21407 | NSC 15919 | 6UA | AI3-17659 | PS-4527 | SB55545 | 4(1H)-Pyrimidinone, 6-amino-2-hydroxy- (9CI) | F3318-0152 | NSC7367 | NSC-7367 | 6-aminopyrimidine-2,4(1

Storage

Room temperature,Argon charged

Shipped In

Normal

Specifications

Synonyme

6-Amino-1H-pyrimidine-2,4-dione | FT-0660294 | EINECS 212-854-3 | 6-Aminouracil, 97% | EN300-21407 | NSC 15919 | 6UA | AI3-17659 | PS-4527 | SB55545 | 4(1H)-Pyrimidinone, 6-amino-2-hydroxy- (9CI) | F3318-0152 | NSC7367 | NSC-7367 | 6-aminopyrimidine-2,4(1

Spezifikationen & Reinheit

≥98%

Storage

Room temperature,Argon charged

Verschickt in

Normal

Reinheit

≥98%

Namen und Kennungen

Pubchem Sid

488184479

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488184479

Kanonisches Lächeln

C1=C(NC(=O)NC1=O)N

IUPAC Name

6-amino-1H-pyrimidine-2,4-dione

InChIKey

LNDZXOWGUAIUBG-UHFFFAOYSA-N

INCHI

1S/C4H5N3O2/c5-2-1-3(8)7-4(9)6-2/h1H,(H4,5,6,7,8,9)

Isomere SMILES

C1=C(NC(=O)NC1=O)N

WGK Deutschland

3

RTECS

YQ8750000

Molekulargewicht

127.1

Beilstein

120491

Reaxy-Rn

120491

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=120491&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Klasse Diazines
      • Subclass Pyrimidines and pyrimidine derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: Diazines
• Subclass: Pyrimidines and pyrimidine derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyrimidones
• Alternative Parents: Aminopyrimidines and derivatives Hydropyrimidines Vinylogous amides Heteroaromatic compounds Ureas Lactams Azacyclic compounds Primary amines Organopnictogen compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Aminopyrimidine - Pyrimidone - Hydropyrimidine - Vinylogous amide - Heteroaromatic compound - Lactam - Urea - Azacycle - Organic oxide - Organic nitrogen compound - Organopnictogen compound - Primary amine - Organooxygen compound - Organonitrogen compound - Amine - Organic oxygen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as pyrimidones. These are compounds that contain a pyrimidine ring, which bears a ketone. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.
• External Descriptors: Not available

Data sources

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

Zugehörige Ziele (nicht menschlich)

deoA Thymidine phosphorylase (531 Activities)

Discover Target: deoA

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Löslichkeit: Soluble in water
• Empfindlichkeit: air sensitive
• Schmelzpunkt (°C): >300°C
• Molekulargewicht: 127.100 g/mol
• XLogP3: -1.600
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 127.038 Da
• Monoisotopic Mass: 127.038 Da
• Topological Polar Surface Area: 84.200 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 196.000
• 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

Häufig gestellte Fragen

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 873-83-6, the molecular formula is C4H5N3O2, and the molecular weight is 127.1 g/mol. InChIKey LNDZXOWGUAIUBG-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.