6- (Hydroxymethyl) uracil

CAT: 0127-OR89744-01Size: 250 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0127-OR89744-01Size:250 mg

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

22126-44-9

Purity

98%

Smiles

O=C1NC(C=C(CO)N1)=O

Chemical Information

6-(Hydroxymethyl)uracil

CAS Number	22126-44-9
PubChem CID	97191
IUPAC Name	6-(hydroxymethyl)-1H-pyrimidine-2,4-dione
Molecular Formula	C5H6N2O3
Molecular Weight	142.11
XLogP	-2
Topological Polar Surface Area	78.4
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Heavy Atom Count	10
Formal Charge	0
Complexity	209

SMILES

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

InChI

InChI=1S/C5H6N2O3/c8-2-3-1-4(9)7-5(10)6-3/h1,8H,2H2,(H2,6,7,9,10)

InChIKey

JVZRLPFSWSIONO-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 22126-44-9

CID: 97191

Formula: C5H6N2O3

MW: 142.11

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	142.11
XLogP3	-2
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	142.03784206
Monoisotopic Mass	142.03784206
Topological Polar Surface Area	78.4 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	209
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR4151-01	5- (Hydroxymethyl) uracil
PC1992-01	6- (Trifluoromethyl) uracil
OR18285-01	6- (Chloromethyl) uracil
OR30565-01	6- (Hydroxymethyl) isoquinoline
OR96261-01	6- (Hydroxymethyl) picolinamide
OR4145	Uracil-6-carboxaldehyde monohydrate
OR1040222-01	6- (Hydroxymethyl) -3-methoxypicolinonitrile
OR10508-01	6- (Hydroxymethyl) -1H-indole
OR14489-01	6- (Hydroxymethyl) -2-methylquinoline
OR1103046-01	6- (Hydroxymethyl) nicotinic acid