4-Chloro-2-methyl-5H,7H-furo[3,4-D]pyrimidine
Basic information
- CAS
36267-73-9- Standard SMILES
Cc1nc(Cl)c2c(n1)COC2- InChIKey
RNICCCUVAPEBMO-UHFFFAOYSA-N- Molecular formula
- C7H7ClN2O
- Average molar mass
- 170.59 g/mol
- Monoisotopic mass
- 170.0246905
Names & identifiers
- Preferred name
- 4-Chloro-2-methyl-5H,7H-furo[3,4-D]pyrimidine
- IUPAC
- 4-chloro-2-methyl-5,7-dihydrofuro[3,4-d]pyrimidine
Names & synonyms
36267-73-94-CHLORO-5,7-DIHYDRO-2-METHYLFURO[3,4-D]PYRIMIDINE4-CHLORO-2-METHYL-5H,7H-FURO[3,4-D]PYRIMIDINESCHEMBL4908918RNICCCUVAPEBMO-UHFFFAOYSA-N4-CHLORO-2-METHYL-5,7-DIHYDROFURO[3,4-D]PYRIMIDINEAKOS015969025AB75811DB-358084
Database identifiers
- CAS
36267-73-9- PubChem CID
- 21554597
- EC Number
- 170-851-1
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 35 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 155
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
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Compound notes
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