Heptobarbital

Heptobarbital
Clinical data
ATC code	None;
Legal status
Legal status	CA: Schedule IV;
Identifiers
	IUPAC name 5-methyl-5-phenylpyrimidine-2,4,6(1H,3H,5H)-trione;
CAS Number	76-94-8;
PubChem CID	66160;
ChemSpider	59547;
UNII	GFR227X6YY;
CompTox Dashboard (EPA)	DTXSID00226900 ;
ECHA InfoCard	100.000.905
Chemical and physical data
Formula	C11H10N2O3
Molar mass	218.212 g·mol−1
3D model (JSmol)	Interactive image;
	SMILES O=C1NC(=O)NC(=O)C1(c2ccccc2)C;
	InChI InChI=1S/C11H10N2O3/c1-11(7-5-3-2-4-6-7)8(14)12-10(16)13-9(11)15/h2-6H,1H3,(H2,12,13,14,15,16); Key:LSAOZCAKUIANSQ-UHFFFAOYSA-N;

Heptobarbital (Rutonal), also known as phenylmethylbarbituric acid is a barbiturate derivative.^[1]^[2]^[3] It has often been confused with methylphenobarbital because both drugs contain a methyl phenyl moiety and are overall very similar in structure.

References

^ Martin JR, Godel T, Hunkeler W, Jenck F, Moreau JL, Sleight AJ, Widmer U (11 January 2001). Kirk-Othmer Encyclopedia of Chemical Technology, 4th Edition. Vol. 5. Wiley Interscience. doi:10.1002/0471238961.1619250313011820.a01. ISBN 978-0-471-41961-7. {{cite book}}: |journal= ignored (help)
^ Hvorost A (2010). "Phenylmethylbarbituric Acid". Analysis of Drugs and Poisons. Archived from the original on 7 April 2012. Retrieved 28 November 2011.
^ Sinnema YA (January 1967). "The identification and determination of barbiturates in serum". Zeitschrift für klinische Chemie und klinische Biochemie. 5 (1): 21–5. doi:10.1515/cclm.1967.5.1.21. PMID 5594996. S2CID 15422152.

[KirkOthmer2001-1] Martin JR, Godel T, Hunkeler W, Jenck F, Moreau JL, Sleight AJ, Widmer U (11 January 2001). Kirk-Othmer Encyclopedia of Chemical Technology, 4th Edition. Vol. 5. Wiley Interscience. doi:10.1002/0471238961.1619250313011820.a01. ISBN 978-0-471-41961-7. {{cite book}}: |journal= ignored (help)

[urlPhenylmethylbarbituric_Acid:_Analysis_of_Drugs_and_Poisons-2] Hvorost A (2010). "Phenylmethylbarbituric Acid". Analysis of Drugs and Poisons. Archived from the original on 7 April 2012. Retrieved 28 November 2011.

[pmid5594996-3] Sinnema YA (January 1967). "The identification and determination of barbiturates in serum". Zeitschrift für klinische Chemie und klinische Biochemie. 5 (1): 21–5. doi:10.1515/cclm.1967.5.1.21. PMID 5594996. S2CID 15422152.

[1]

[2]

[3]

Clinical data

ATC code	None
Legal status
Legal status	CA: Schedule IV
Identifiers
IUPAC name 5-methyl-5-phenylpyrimidine-2,4,6(1H,3H,5H)-trione
CAS Number	76-94-8
PubChem CID	66160
ChemSpider	59547
UNII	GFR227X6YY
CompTox Dashboard (EPA)	DTXSID00226900
ECHA InfoCard	100.000.905
Chemical and physical data
Formula	C₁₁H₁₀N₂O₃
Molar mass	218.212 g·mol⁻¹
3D model (JSmol)	Interactive image
SMILES O=C1NC(=O)NC(=O)C1(c2ccccc2)C
InChI InChI=1S/C11H10N2O3/c1-11(7-5-3-2-4-6-7)8(14)12-10(16)13-9(11)15/h2-6H,1H3,(H2,12,13,14,15,16) Key:LSAOZCAKUIANSQ-UHFFFAOYSA-N

Heptobarbital

See also

References