Basic information
- CAS
1185306-26-6- Standard SMILES
Clc1cc(-c2cccc(Br)n2)nc(Cl)n1- InChIKey
WJPYURTVKHODHJ-UHFFFAOYSA-N- Molecular formula
- C9H4BrCl2N3
- Average molar mass
- 304.95 g/mol
- Monoisotopic mass
- 302.89657
Names & identifiers
- Preferred name
- 2,4-Dichloro-6-(6'-bromo-2'-pyridyl)pyrimidine
- IUPAC
- 4-(6-bromo-2-pyridinyl)-2,6-dichloropyrimidine
Names & synonyms
2,4-Dichloro-6-(6'-bromo-2'-pyridyl)pyrimidine1185306-26-6RefChem:443339824-323-94-(6-bromopyridin-2-yl)-2,6-dichloropyrimidineAKOS015943684CS-35621EN300-1718647
Database identifiers
- CAS
1185306-26-6- PubChem CID
- 45787243
- EC Number
- 824-323-9
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 220
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, P317, 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%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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