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ChemicalBook--->CAS DataBase List--->652-37-9

652-37-9

652-37-9 Structure

652-37-9 Structure
IdentificationMore
[Name]

Theophylline-7-acetic acid
[CAS]

652-37-9
[Synonyms]

(1,3-DIMETHYL-2,6-DIOXO-1,2,3,6-TETRAHYDRO-PURIN-7-YL)-ACETIC ACID
1,3-DIMETHYLXANTHINE-7-ACETIC ACID
7-THEOPHYLLINE ACETIC ACID
ACEFYLLINE
AKOS BBS-00003810
LABOTEST-BB LT00053164
THEOPHYLLINE-7-ACETIC ACID
THEOPHYLLINEACETIC ACID
1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-purine-7-aceticaci
1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurine-7-aceticacid
7-(carboxymethyl)theophylline
7-theophyllinylaceticacid
acephylline
acidetheophylline-ethanoique-7
theophyllin-7-ylacetic acid
7-Theophyline Acetic Acid
CAFFEINE CARBOXYLIC ACID
Theophylline-7-aceticacid,98%
Carboxymethyltheophylline
THEOPHYLINE ACETIC ACID
[EINECS(EC#)]

211-490-2
[Molecular Formula]

C9H10N4O4
[MDL Number]

MFCD00022832
[Molecular Weight]

238.2
[MOL File]

652-37-9.mol
Chemical PropertiesBack Directory
[Melting point ]

270-272 °C
[Boiling point ]

269-271 C
[density ]

1?+-.0.1 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,Room Temperature
[solubility ]

DMSO (Slightly)
[form ]

Solid
[pka]

3.72±0.10(Predicted)
[color ]

White
[Merck ]

14,24
[BRN ]

279221
[LogP]

-0.490 (est)
[CAS DataBase Reference]

652-37-9(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
[WGK Germany ]

2
[RTECS ]

UO7451300
[HS Code ]

2939.59.0000
Hazard InformationBack Directory
[Chemical Properties]

White Solid
[Uses]

A xanthine derivative with bronchodilator activity. Typically combined as salt component with other medications such as Ambroxol to treat bronchial and pulmonary diseases.
[Uses]

A xanthine derivative with bronchodilator activity. Typically combined as salt component with other medications such as Ambroxol to treat bronchial and pulmonary diseases.
[Uses]

Bronchospasm;Adenosine receptor antagonist
[Definition]

ChEBI: 2-(1,3-dimethyl-2,6-dioxo-7-purinyl)acetic acid is an oxopurine.
Spectrum DetailBack Directory
[Spectrum Detail]

Theophylline-7-acetic acid(652-37-9)1HNMR
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

Theophylline-7-acetic acid, 98%(652-37-9)
[Sigma Aldrich]

652-37-9(sigmaaldrich)
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