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5-allyl-6-hydroxy-1H-pyrimidin-4-one - 97%, high purity , CAS No.16019-30-0

COA

Grade & Purity:

≥97%

Cas Number: 16019-30-0
Molecular Weight: 152.15
PubChem CID: 25421575

In stock

Item Number

A629783

Grouped product items
SKU	Size	Availability	Price
A629783-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$199.90
A629783-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$761.90
A629783-10g	10g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,521.90

Basic Description

Synonyms	5-allylpyrimidine-4,6-diol \| 16019-30-0 \| 4-hydroxy-5-prop-2-enyl-1H-pyrimidin-6-one \| 23903-65-3 \| 5-ALLYL-6-HYDROXYPYRIMIDIN-4(3H)-ONE \| 5-allylpyrimidine-4,6(1H,5H)-dione \| 5-Allyl-6-hydroxy-3H-pyrimidin-4-one \| 6-hydroxy-5-(prop-2-en-1-yl)-3,4-dihydro
Specifications & Purity	≥97%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Diazines
    - Subclass Pyrimidines and pyrimidine derivatives

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Diazines
Subclass	Pyrimidines and pyrimidine derivatives
Intermediate Tree Nodes	Not available
Direct Parent	Hydroxypyrimidines
Alternative Parents	Pyrimidones Hydropyrimidines Vinylogous acids Heteroaromatic compounds Lactams Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Hydroxypyrimidine - Pyrimidone - Hydropyrimidine - Heteroaromatic compound - Vinylogous acid - Lactam - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as hydroxypyrimidines. These are organic compounds containing a hydroxyl group attached to a pyrimidine ring. 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
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

Names and Identifiers

IUPAC Name	4-hydroxy-5-prop-2-enyl-1H-pyrimidin-6-one
INCHI	InChI=1S/C7H8N2O2/c1-2-3-5-6(10)8-4-9-7(5)11/h2,4H,1,3H2,(H2,8,9,10,11)
InChIKey	QWYRCXSPNDGEAQ-UHFFFAOYSA-N
Smiles	C=CCC1=C(N=CNC1=O)O
Isomeric SMILES	C=CCC1=C(N=CNC1=O)O
PubChem CID	25421575
Molecular Weight	152.15

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	152.150 g/mol
XLogP3	0.200
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	152.059 Da
Monoisotopic Mass	152.059 Da
Topological Polar Surface Area	61.700 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	253.000
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

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