Basic information
- CAS
1521920-36-4- Standard SMILES
COc1cc(Cl)nc(C2CC2)n1- InChIKey
ZCGKRSQYMJSBOX-UHFFFAOYSA-N- Molecular formula
- C8H9ClN2O
- Average molar mass
- 184.62 g/mol
- Monoisotopic mass
- 184.0403406
Names & identifiers
- Preferred name
- 4-Chloro-2-cyclopropyl-6-methoxypyrimidine
- IUPAC
- 4-chloro-2-cyclopropyl-6-methoxypyrimidine
Names & synonyms
4-chloro-2-cyclopropyl-6-methoxypyrimidine1521920-36-4RefChem:521018969-100-8MFCD24018838SCHEMBL18097454AKOS0195182464-chloro-2-cyclopropyl-6-methoxy-pyrimidineF534395
Database identifiers
- CAS
1521920-36-4- PubChem CID
- 80949381
- EC Number
- 969-100-8
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 35 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 163
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.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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