6-chloro-3-methyl-5-propyl-1H-pyrimidine-2,4-dione
Basic information
- CAS
25028-04-0- Standard SMILES
CCCc1c(Cl)[nH]c(=O)n(C)c1=O- InChIKey
AELAEAWCPNYMJD-UHFFFAOYSA-N- Molecular formula
- C8H11ClN2O2
- Average molar mass
- 202.64 g/mol
- Monoisotopic mass
- 202.0509053
Names & identifiers
- Preferred name
- 6-chloro-3-methyl-5-propyl-1H-pyrimidine-2,4-dione
- IUPAC
- 6-chloro-3-methyl-5-propyl-1H-pyrimidine-2,4-dione
Names & synonyms
NSC35792625028-04-0DTXSID50320326NSC-3579266-Chloro-3-methyl-5-propylpyrimidine-2,4(1H,3H)-dione
Database identifiers
- CAS
25028-04-0- PubChem CID
- 337904
- DTXSID
DTXSID50320326
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 49.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 286
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Compound notes
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