Preliminary reference disclaimer
This preliminary safety reference is generated from structured MolGraph catalog fields and public reference-style data. It is not a supplier-issued Safety Data Sheet and should not be used as a substitute for supplier-issued documentation, workplace safety review, transport classification, or regulatory compliance decisions. For supplier SDS or COA, submit a documentation request through MolGraph.
Documentation status
Preliminary safety reference
Available
Supplier-issued SDS
Available by request
COA
Available by RFQ / lot confirmation
Transport classification
Requires shipment review
Identity
CAS Number
101072-04-2
Chemical name
8-bromo-3-methyl-7-(2-oxo-2-phenylethyl)-1H-purine-2,6(3H,7H)-dione
Molecular formula
C14H11BrN4O3
Molecular weight
363.17 g/mol
Synonyms
8-bromo-3-methyl-7-(2-oxo-2-phenylethyl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione; 8-bromo-3-methyl-7-(2-oxo-2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione; 8-bromo-3-methyl-7-(2-oxo-2-phenylethyl)-1,3,7-trihydropurine-2,6-dione; Oprea1_263478; Oprea1_633647; C14H11BrN4O3; 7-phenacyl-8-bromo-3-methylxanthine; 8-bromo-3-methyl-7-phenacyl-purine-2,6-dione
InChIKey
MDRUDFVHNBRYOO-UHFFFAOYSA-N
PubChem CID
986070
Hazard / GHS Reference
Signal word
Warning
Catalog reference cue; confirm supplier documentation before use.
Hazard statements
H302, H315, H319, H335
Catalog reference cue; confirm supplier documentation before use.
Handling & PPE
Handling and PPE reference fields are not available in the current MolGraph catalog record.
First Aid / Accidental Release
First aid and accidental release reference fields are not available in the current MolGraph catalog record.
Firefighting / Stability
Firefighting and stability reference fields are not available in the current MolGraph catalog record.
Physical and Chemical Reference
XLogP
1.9
Catalog reference value; verify against supplier SDS before use.
Transport / Shipment Review
Shipment review
Shipment details require review before fulfillment.
Transport classification must be confirmed using supplier SDS and shipment documentation before dispatch.
- Transport classification must be confirmed using supplier SDS and shipment documentation before dispatch.