CAS
503-93-5 Purity
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503-93-5 Purity
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Protheobromine
CAS
50-39-5
Catalog Number
ACM50395
Category
Other Products
Molecular Weight
238.246
Molecular Formula
C10H14N4O3
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Specification
Synonyms
Protheobromine, Cordaleromin, Pantobromino, Protheobromin, Cordabromin, Vascopil, Bonicor, Corodil, Theocor, Proteobromina, Protheobrominum, Pro-Cor, TEBE, beta-Oxypropyltheobromine, Protheobromine [INN], Proteobromina [INN-Spanish], Protheobrominum [INN-Latin], 1-(2-Hydroxypropyl)theobromine, l-(beta-Hydroxypropyl)theobromine, EINECS 200-034-8
IUPAC Name
1-(2-hydroxypropyl)-3,7-dimethylpurine-2,6-dione
Canonical SMILES
CC(CN1C(=O)C2=C(N=CN2C)N(C1=O)C)O
InChI Key
MXRGZXBFSKSZPH-UHFFFAOYSA-N
Boiling Point
493.1ºC at 760mmHg
Flash Point
252ºC
Density
1.46g/cm³
EC Number
200-034-8
Exact Mass
238.10700
H-Bond Acceptor
4
H-Bond Donor
1
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