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1,5,5-Trimethylhydantoin

CAT: 0607-C6977-100Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0607-C6977-100Size:100 mg
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CAS Number
6851-81-6
Product Name Alternative
1,5,5-trimethylimidazolidine-2,4-dione
Sequence
TMH
Field of Research
Others
Purity
0.98
Solubility
≥27.4 mg/mL in DMSO; ≥24.8 mg/mL in EtOH; ≥26.8 mg/mL in H2O
Smiles
O=C1NC(C(C)(N1C)C)=O
Molecular Formula
C6H10N2O2
Molecular Weight
142.16
Shipping Conditions
Blue ice
Storage Conditions
Store at 4°C, stored under nitrogen.

Chemical Information

1,5,5-Trimethylimidazolidine-2,4-dione
CAS Number6851-81-6
PubChem CID81295
IUPAC Name1,5,5-trimethylimidazolidine-2,4-dione
Molecular FormulaC6H10N2O2
Molecular Weight142.16
XLogP-0.3
Topological Polar Surface Area49.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count10
Formal Charge0
Complexity198
SMILES
CC1(C(=O)NC(=O)N1C)C
InChI
InChI=1S/C6H10N2O2/c1-6(2)4(9)7-5(10)8(6)3/h1-3H3,(H,7,9,10)
InChIKey
ZNYIPTYJBRGSSL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1,5,5-Trimethylimidazolidine-2,4-dione
CAS: 6851-81-6
CID: 81295
Formula: C6H10N2O2
MW: 142.16
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight142.16
XLogP3-0.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass142.074227566
Monoisotopic Mass142.074227566
Topological Polar Surface Area49.4 Ų
Heavy Atom Count10
Formal Charge0
Complexity198
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