Basic information
- CAS
41862-13-9- Standard SMILES
CCn1c(N)cc(=O)n(C)c1=O- InChIKey
DWCWSRSRTSZFNF-UHFFFAOYSA-N- Molecular formula
- C7H11N3O2
- Average molar mass
- 169.18 g/mol
- Monoisotopic mass
- 169.0851266
Names & identifiers
- Preferred name
- 6-Amino-3-methyl-1-(ethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione
- IUPAC
- 6-amino-1-ethyl-3-methylpyrimidine-2,4-dione
- English name
- 6-aMino-3-Methyl-1-(ethyl)-1,2,3,4-tetrahydropyriMidine-2,4-dione
- Molecular formula
- C7H11N3O2
- Molecular weight
- 169.18
Names & synonyms
41862-13-96-amino-1-ethyl-3-methylpyrimidine-2,4(1H,3H)-dione6-amino-3-methyl-1-(ethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione6-Amino-1-ethyl-3-methyl-2,4(1H,3H)-pyrimidinedione6-amino-1-ethyl-3-methylpyrimidine-2,4-dioneMFCD206973406-amino-1-ethyl-3-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dioneSCHEMBL17582653DWCWSRSRTSZFNF-UHFFFAOYSA-NDTXSID901225535AKOS022637861SB56437
Show more names
2,4(1H,3H)-Pyrimidinedione, 6-amino-1-ethyl-3-methyl-
AS-71855SY265092DS-015712CS-0323227A116966-amino-1-ethyl-3-methyl-pyrimidine-2,4-dioneF724659
Database identifiers
- CAS
41862-13-9- PubChem CID
- 14425317
- DTXSID
DTXSID901225535
Properties
Computed structural properties
- XLogP
- -0.7
- Topological polar surface area
- 66.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 259
Physicochemical properties
- Melting point
- 232 · 232-233 °C
- Boiling point
- 259.6 · 259.6±43.0 °C(Predicted)
- Density
- 1.225 · 1.225±0.06 g/cm3(Predicted)
- pka
- 5.16 · 5.16±0.70(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Suppliers6 total
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
雷丁试剂0510-85629785 18013409632 · [email protected]
上海平果医药科技有限公司021-20432229 · [email protected]
南京阿斯法姆医药科技有限公司02558867862; 18751812725 · [email protected]
上海固帮新材料科技有限公司021-51317962 · [email protected]
上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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