Basic information
- CAS
15755-12-1- Standard SMILES
CC(=O)Nc1nc(C)cc(C)n1- InChIKey
MQNFNEJOMMYIOX-UHFFFAOYSA-N- Molecular formula
- C8H11N3O
- Average molar mass
- 165.19 g/mol
Names & identifiers
- Preferred name
- 2-Acetamido-4,6-dimethylpyrimidine
- IUPAC
- N-(4,6-dimethylpyrimidin-2-yl)acetamide
- English name
- N-(4,6-dimethyl-pyrimidin-2-yl)-acetamide
- Molecular formula
- C8H11N3O
- Molecular weight
- 165.19
Names & synonyms
15755-12-12-acetamido-4,6-dimethylpyrimidineRefChem:462741661-735-6N-(4,6-dimethylpyrimidin-2-yl)acetamideN-(4,6-dimethyl-pyrimidin-2-yl)-acetamideSCHEMBL11463095MQNFNEJOMMYIOX-UHFFFAOYSA-NAKOS024324729DA-43943N-(4,6-dimethyl-2-pyrimidinyl)acetamideAcetamide, N-(4,6-dimethyl-2-pyrimidinyl)-
Database identifiers
- CAS
15755-12-1- PubChem CID
- 3489296
- EC Number
- 661-735-6
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 54.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 162
Physicochemical properties
- Density
- 1.167 · 1.167±0.06 g/cm3(Predicted)
- pka
- 12.51 · 12.51±0.70(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Chemistry & industry
Suppliers1 total
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
Related reactions
1 records
Compound notes
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