Basic information
- CAS
1197-28-0- Standard SMILES
CCCc1nc(Cl)cc(Cl)n1- InChIKey
AYIVVSYNNZZADH-UHFFFAOYSA-N- Molecular formula
- C7H8Cl2N2
- Average molar mass
- 191.05 g/mol
- Monoisotopic mass
- 190.00645362
Names & identifiers
- Preferred name
- 4,6-Dichloro-2-propylpyrimidine
- IUPAC
- 4,6-dichloro-2-propylpyrimidine
- English name
- 4,6-Dichloro-2-propyl-pyrimidine
- Molecular formula
- C7H8Cl2N2
- Molecular weight
- 191.06
Names & synonyms
4,6-dichloro-2-propylpyrimidine1197-28-0Pyrimidine, 4,6-dichloro-2-propyl-4,6-DICHLORO-2-PROPYL-PYRIMIDINE4,6-Dichloro-2-(n-propyl)pyrimidineSCHEMBL1318031DTXSID30597317AYIVVSYNNZZADH-UHFFFAOYSA-NMFCD11218562AKOS005266608CS-365514,6-Dichloro-2-propylpyrimidine, AldrichCPR
Show more names
F87038F980028
Database identifiers
- CAS
1197-28-0- PubChem CID
- 19006790
- DTXSID
DTXSID30597317
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 25.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 111
Physicochemical properties
- Boiling point
- 244.6 · 244.6±20.0 °C(Predicted)
- Density
- 1.2435 g/cm3 · 1.2435 g/cm3
- storage temp.
- -20 °C, · -20°C, sealed storage, away from moisture
- pka
- -3.77 · -3.77±0.30(Predicted)
- Appearance
- Colorless to light yellow Liquid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers5 total
康姆芘法思（上海）生物科技有限公司021-65232103 17602124823 · [email protected]
济南鑫宏泰化学有限公司13000000000 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
陕西缔都化学有限公司17691182729 17392216275 · [email protected]
Nanjing Moldeep Biochemical Co., Ltd.+86-25-58282389 +86-17351037455 · [email protected]
Related reactions
2 records
Compound notes
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