Basic information
- CAS
56076-21-2- Standard SMILES
CCOc1ncc(F)c(N)n1- InChIKey
UNPWKSQAHRVMMH-UHFFFAOYSA-N- Molecular formula
- C6H8FN3O
- Average molar mass
- 157.15 g/mol
- Monoisotopic mass
- 157.06514005
Names & identifiers
- Preferred name
- 2-Ethoxy-5-fluoropyrimidin-4-amine
- IUPAC
- 2-ethoxy-5-fluoropyrimidin-4-amine
- English name
- 2-ethoxy-5-fluoropyrimidin-4-amine
- Molecular formula
- C6H8FN3O
- Molecular weight
- 157.15
Names & synonyms
2-Ethoxy-5-fluoropyrimidin-4-amine56076-21-2C6H8FN3OMFCD18973123EINECS 259-981-0SCHEMBL13530555DTXSID40204626AKOS016845588DS-2961FS-3791SB57366CS-0151440
Show more names
4-Pyrimidinamine, 2-ethoxy-5-fluoro-
2-Ethoxy-5-fluoro-pyrimidin-4-ylamine2-Ethoxy-5-fluoro-4-pyrimidinamineAMY104Fluorouracil Impurity 47A852017UNPWKSQAHRVMMH-UHFFFAOYSA-N4-Amino-2-ethoxy-5-fluoropyrimidine2-ethoxy-5-fluoro-pyrimidin-4-amine
Database identifiers
- CAS
56076-21-2- PubChem CID
- 92005
- DTXSID
DTXSID40204626- EC Number
- 259-981-0
- Nikkaji
- J296.561E
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 61 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 124
Physicochemical properties
- Boiling point
- 285.5 · 285.5±43.0 °C(Predicted)
- Density
- 1.278 · 1.278±0.06 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2–8 °C
- pka
- 3.76 · 3.76±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- HS Code
- 2933599590 · 2933599590
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
- hs_code
- 2933599590
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Suppliers14 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Aladdin Scientific[email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
上海寰川实业有限公司021-61478794 · [email protected]
上海洽凡生化科技有限公司+86-021-61654350 · [email protected]
江西弗莱医药科技有限公司15870833005 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 15955137747 · [email protected]
南京阿斯法姆医药科技有限公司02558867862; 18751812725 · [email protected]
上海蓝乐鸟实业有限公司15021845385 · [email protected]
山西诺诚生物科技有限公司17835231871 · [email protected]
郑州汇聚化工有限公司037155153829 18003835034 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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