Ambuphylline
CAS Registry Number®
5634-34-4
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CAS Name
AmbuphyllineMolecular Formula
C7H8N4O2.C4H11NOCite this Page
Ambuphylline. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=5634-34-4 (retrieved ) (CAS RN: 5634-34-4). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
254-256 °C
Source(s)
- (1) Drugs - Synonyms and Properties data were obtained from Ashgate Publishing Co. (US)
Other Names and Identifiers
InChI
InChI=1S/C7H8N4O2.C4H11NO/c1-10-5-4(8-3-9-5)6(12)11(2)7(10)13;1-4(2,5)3-6/h3H,1-2H3,(H,8,9);6H,3,5H2,1-2H3
InChIKey
InChIKey=SEIRRUDMPNNSCY-UHFFFAOYSA-N
SMILES
C(CO)(C)(C)N.O=C1C2=C(N(C)C(=O)N1C)N=CN2
Canonical SMILES
O=C1C=2NC=NC2N(C(=O)N1C)C.OCC(N)(C)C
Other Names for this Substance
- 1H-Purine-2,6-dione, 3,9-dihydro-1,3-dimethyl-, compd. with 2-amino-2-methyl-1-propanol (1:1)
- Theophylline, compd. with 2-amino-2-methyl-1-propanol (1:1)
- 1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-, compd. with 2-amino-2-methyl-1-propanol (1:1)
- 1-Propanol, 2-amino-2-methyl-, compd. with theophylline (1:1)
- 1-Propanol, 2-amino-2-methyl-, compd. with 3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione (1:1)
