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(+/-) -4-Hydroxy Mephenytoin

CAT: 0024-sc-210197DSize: 10 mgDry Ice: NoHazardous: No
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CAT#:0024-sc-210197DSize:10 mg
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CAS Number
61837-65-8

Chemical Information

4-Hydroxymephenytoin

Hydroxymephenytoin is an imidazolidine-2,4-dione.

CAS Number61837-65-8
PubChem CID119507
IUPAC Name5-ethyl-5-(4-hydroxyphenyl)-3-methylimidazolidine-2,4-dione
Molecular FormulaC12H14N2O3
Molecular Weight234.25
XLogP1.2
Topological Polar Surface Area69.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count17
Formal Charge0
Complexity337
SMILES
CCC1(C(=O)N(C(=O)N1)C)C2=CC=C(C=C2)O
InChI
InChI=1S/C12H14N2O3/c1-3-12(8-4-6-9(15)7-5-8)10(16)14(2)11(17)13-12/h4-7,15H,3H2,1-2H3,(H,13,17)
InChIKey
OQPLORUDZLXXPD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-Hydroxymephenytoin
CAS: 61837-65-8
CID: 119507
Formula: C12H14N2O3
MW: 234.25
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight234.25
XLogP31.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass234.10044231
Monoisotopic Mass234.10044231
Topological Polar Surface Area69.6 Ų
Heavy Atom Count17
Formal Charge0
Complexity337
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes