Theophylline 7-Acetic Acid

cas: 652-37-9 — see every product listed under this CAS number, including other names

Theophylline 7-Acetic Acid (CAS 652-37-9) is a chemical reagent available from Chemat. Available pack sizes: on request. Offered by: Chemat Brand.

brandChemat Brand
catalog numberULT601
cas652-37-9
sizeon request
availability Do potwierdzenia przez Chemat|To be confirmed by Chemat
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categoryChemicals
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Structural formula: {0} (CAS {1})

2-(1,3-dimethyl-2,6-dioxo-7-purinyl)acetic acid is an oxopurine.

Source: ChEBI

Identity
Molecular formulaC9H10N4O4
Molecular weight238.20 g/mol
IUPAC name2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetic acid
InChIKeyHCYFGRCYSCXKNQ-UHFFFAOYSA-N
SMILESCN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)O

Computed by PubChem (NCBI)

Synonyms: Acefylline, Theophylline-7-acetic acid, Acephylline, Theophyllineacetic acid, 7-(Carboxymethyl)theophylline, 7-Theophyllineacetic acid, 7-Theophyllinylacetic acid, 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetic acid, caffeine carboxylic acid, Doxophylline metabolite m2
Isomers (same molecular formula)
3-(3-methyl-2,6-dioxo-7H-purin-8-yl)propanoic acid C9H10N4O4
2,4-dinitro-N-[(E)-propylideneamino]aniline C9H10N4O4
N-(6-acetamido-5-nitro-2-pyridinyl)acetamide C9H10N4O4
2-amino-N-(2-amino-2-oxoethyl)-5-nitrobenzamide C9H10N4O4
2-[4-(2,4-dioxo-1,3-diazinan-1-yl)pyrazol-1-yl]acetic acid C9H10N4O4
2,4-dinitro-N-(propan-2-ylideneamino)aniline C9H10N4O4
2,3,5-trideuterio-4,6-dinitro-N-(propan-2-ylideneamino)aniline C9H10N4O4
2,4-dinitro-N-((1,2,3-13C3)propan-2-ylideneamino)aniline C9H10N4O4
oxalic acid;1H-pyrazolo[4,5-b]pyridin-6-ylmethanamine C9H10N4O4
2,4-dinitro-N-[(E)-propylideneamino]aniline C9H10N4O4
2-(3,7-dimethyl-2,6-dioxopurin-1-yl)acetic acid C9H10N4O4
3-(3-methyl-2,6-dioxo-7H-purin-1-yl)propanoic acid C9H10N4O4

Also listed as

Theophylline-7-acetic acid Chemat Brand CAS 652-37-9
Acefylline Mikromol CAS 652-37-9
Acefylline/ 99.95% (existing batch purity) TargetMol CAS 652-37-9
Theophylline-7-acetic acid, 98% Thermo Scientific (Alfa Aesar) CAS 652-37-9
Theophylline-7-acetic Acid, >98.0%(HPLC)(T) TCI CAS 652-37-9
7H-Purine-7-aceticacid, 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-, 98%, 98% Chemat CAS 652-37-9
Acefylline, 99.93% MedChemExpress CAS 652-37-9
Acefylline (GMP) MedChemExpress CAS 652-37-9
Acefylline (Standard) MedChemExpress CAS 652-37-9
Theophylline-7-acetic Acid, 99+% Ambeed CAS 652-37-9