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Creatinine

CAT: 0013-GTR19161293-01Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19161293-01Size:500 mg
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Description
Creatinine is a break-down product of creatine phosphate in muscle, and is usually produced at a fairly constant rate by the body.
CAS Number
60-27-5
Product Name Alternative
Creatinine | NSC 13123 | NSC-13123 | NSC13123
Field of Research
Kidney & Urological Research
Purity
>98% (HPLC)
Solubility
Water: 23 mg/mL (203.32 mM)
Smiles
O=C (CN1C) NC1=N
Molecular Formula
C4H7N3O
Molecular Weight
113.12
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.
Other Product Names
2-Imino-1-methylimidazolidin-4-one

Chemical Information

creatinine

Creatinine is a lactam obtained by formal cyclocondensation of creatine. It is a metabolite of creatine. It has a role as a diagnostic agent and a human metabolite. It is a lactam and an imidazolidinone. It is functionally related to a creatine.

CAS Number60-27-5
PubChem CID588
IUPAC Name2-amino-3-methyl-4H-imidazol-5-one
Molecular FormulaC4H7N3O
Molecular Weight113.12
XLogP-1.8
Topological Polar Surface Area58.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count8
Formal Charge0
Complexity151
SMILES
CN1CC(=O)N=C1N
InChI
InChI=1S/C4H7N3O/c1-7-2-3(8)6-4(7)5/h2H2,1H3,(H2,5,6,8)
InChIKey
DDRJAANPRJIHGJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of creatinine
CAS: 60-27-5
CID: 588
Formula: C4H7N3O
MW: 113.12
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight113.12
XLogP3-1.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass113.058911855
Monoisotopic Mass113.058911855
Topological Polar Surface Area58.7 Ų
Heavy Atom Count8
Formal Charge0
Complexity151
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

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