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Pyrimidine

CAT: 0957-E4265-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0957-E4265-01Size:100 mg
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Description
Pyrimidine is an endogenous metabolite. It is used to study the photoinduced ion chemistry of the halogenated pyrimidines, a class of prototype radiosensitizing molecules, and is also used to assess pyrimidine/purine asymmetry quantitatively.
CAS Number
289-95-2
Target
Others
Activity
Others
Molecular Formula
C4H4N2
Storage Conditions
2 years -20°C liquid

Chemical Information

Pyrimidine

Pyrimidine is the parent compound of the pyrimidines; a diazine having the two nitrogens at the 1- and 3-positions. It has a role as a Daphnia magna metabolite. It is a diazine and a member of pyrimidines.

CAS Number289-95-2
PubChem CID9260
IUPAC Namepyrimidine
Molecular FormulaC4H4N2
Molecular Weight80.09
XLogP-0.4
Topological Polar Surface Area25.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count6
Formal Charge0
Complexity32
SMILES
C1=CN=CN=C1
InChI
InChI=1S/C4H4N2/c1-2-5-4-6-3-1/h1-4H
InChIKey
CZPWVGJYEJSRLH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Pyrimidine
CAS: 289-95-2
CID: 9260
Formula: C4H4N2
MW: 80.09
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight80.09
XLogP3-0.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass80.037448136
Monoisotopic Mass80.037448136
Topological Polar Surface Area25.8 Ų
Heavy Atom Count6
Formal Charge0
Complexity32.5
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
TRC-P997330-1GPyrimidine
AR-N01498-01Pyrimidine Impurity
HY-Y0519R-01Pyrimidine (Standard)
ZDA98435-015- (Benzyloxy) pyrimidine
QBA92949-01Pyrimidine-5-carboxamide
ND57369-014- (Dimethoxymethyl) pyrimidine
HY-78975-012- (Hydroxymethyl) -pyrimidine
HY-118295Pyrimidine-indole hybrid
HY-P3178Pyrimidine nucleoside phosphorylase
296187-015- (Hydroxymethyl) pyrimidine

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