2-Chloro-4,6-dimethyl-5-(2-methylpropyl)pyrimidine
Basic information
- CAS
1384428-62-9- Standard SMILES
Cc1nc(Cl)nc(C)c1CC(C)C- InChIKey
YXVNOWLEZAZLBU-UHFFFAOYSA-N- Molecular formula
- C10H15ClN2
- Average molar mass
- 198.69 g/mol
- Monoisotopic mass
- 198.0923762
Names & identifiers
- Preferred name
- 2-Chloro-4,6-dimethyl-5-(2-methylpropyl)pyrimidine
- IUPAC
- 2-chloro-4,6-dimethyl-5-(2-methylpropyl)pyrimidine
Names & synonyms
2-chloro-4,6-dimethyl-5-(2-methylpropyl)pyrimidine1384428-62-9RefChem:468791859-663-72-Chloro-5-isobutyl-4,6-dimethylpyrimidineJFC42862AKOS026727918CS-0274083EN300-94832Z1269676855
Database identifiers
- CAS
1384428-62-9- PubChem CID
- 73994643
- EC Number
- 859-663-7
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 25.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 149
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%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…