8-Cyclopentyl-1,3-dimethylxanthine

Catalog Number

ACM35873495

Product Name

8-Cyclopentyl-1,3-dimethylxanthine

Structure

CAS

35873-49-5

Category

Heterocyclic Organic Compound

Synonyms

8-cyclopentyltheophylline, Cyclopentyltheophylline, 8-Cyclopentyl-1,3-dimethylxanthine, 8-Cyclopentyl theophylline, Spectrum_000351, Lopac-C-102, Spectrum2_001734, Spectrum3_000658, Spectrum4_000760, Spectrum5_001769, Theophylline, 8-cyclopentyl-, Ambmdy02300193, C102_SIGMA, NCIOpen2_006919, Lopac0_000391, BSPBio_002295, KBioGR_001120, KBioSS_000831, MLS000859932, DivK1c_000824

IUPAC Name

8-cyclopentyl-1,3-dimethyl-7H-purine-2,6-dione

Molecular Weight

248.28

Molecular Formula

C₁₂H₁₆N₄O₂

Canonical SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3CCCC3

InChI Key

SCVHFRLUNIOSGI-UHFFFAOYSA-N

Boiling Point

513.1ºC at 760mmHg

Melting Point

250-252ºC

Flash Point

264.1ºC

Density

1.332g/cm³

Exact Mass

248.12700

H-Bond Acceptor

3

H-Bond Donor

1

WGK Germany

3

MSDS

COA

Spec Sheet