6-Methyl-5-cyanouracil - CAS 5900-40-3

Catalog:	BB030227
Product Name:	6-Methyl-5-cyanouracil
CAS:	5900-40-3
Synonyms:	6-methyl-2,4-dioxo-1H-pyrimidine-5-carbonitrile; 6-methyl-2,4-dioxo-1H-pyrimidine-5-carbonitrile

Technical Data

Patents

Computed Properties

IUPAC Name:	6-methyl-2,4-dioxo-1H-pyrimidine-5-carbonitrile
Description:	6-Methyl-5-cyanouracil (CAS# 5900-40-3) is a useful research chemical.
Molecular Weight:	151.12
Molecular Formula:	C6H5N3O2
Canonical SMILES:	CC1=C(C(=O)NC(=O)N1)C#N
InChI:	InChI=1S/C6H5N3O2/c1-3-4(2-7)5(10)9-6(11)8-3/h1H3,(H2,8,9,10,11)
InChI Key:	XUBWKPSLBXEADF-UHFFFAOYSA-N
Density:	1.42 g/cm³
LogP:	-0.75672

Publication Number	Title	Priority Date
CN-110520409-A	Compound and composition for Intracellular delivery therapeutic agent	20170315
CN-109952292-A	Pantonine-carboxyl muconic acid semialdehyde removes the inhibitor of carboxylic acid	20161014
JP-2020500838-A	Inhibitors of Î'-amino-Î'-carboxymuconate semialdehyde decarboxylase	20161014
KR-20190065312-A	Inhibitors of alpha-amino-beta-carboxy-muconic acid semialdehyde decarboxylase	20161014
TW-201817718-A	Inhibitor of Î±-amino-Î²-carboxyhexadienoic acid semialdehyde decarboxylase	20161014

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Related Functional Groups

Nitrogen Compounds

[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[51355-91-0]
1-(Chloromethyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[102388-00-1]
1-(Chloromethyl)-3-nitro-1H-pyrazole
[1281984-38-0]
1-Cyclopentyl-3,5-dinitro-1H-pyrazole
[1170836-25-5]
1-Cyclopentyl-5-nitro-1H-pyrazole
[55877-31-1]
1-Benzofuran-3-carbonitrile

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Complexity:	307
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	151.038176411
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	151.038176411
Rotatable Bond Count:	0
Topological Polar Surface Area:	82
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.7