Basic information
- Standard SMILES
O=Cc1cc2nc(Cl)nc(N3CCOCC3)c2s1- InChIKey
PFAKZIZFIXKDFP-UHFFFAOYSA-N- Molecular formula
- C11H10ClN3O2S
- Average molar mass
- 283.73 g/mol
- Monoisotopic mass
- 283.01822524
Names & identifiers
- Preferred name
- 2-Chloro-4-morpholinothieno[3,2-d]pyrimidine-6-carbaldehyde
- IUPAC
- 2-chloro-4-morpholin-4-ylthieno[3,2-d]pyrimidine-6-carbaldehyde
- English name
- 2-CHLORO-4-MORPHOLINOTHIENO[3,2-D]PYRIMIDINE-6-CARBALDEHYDE
- Molecular formula
- C11H10ClN3O2S
- Molecular weight
- 283.73
Names & synonyms
885618-31-52-Chloro-4-morpholinothieno[3,2-d]pyrimidine-6-carbaldehydeMFCD115208642-chloro-4-(morpholin-4-yl)thieno[3,2-d]pyrimidine-6-carbaldehydeC11H10ClN3O2S2-chloro-4-morpholin-4-ylthieno[3,2-d]pyrimidine-6-carbaldehyde2-Chloro-4-morpholinothieno-[3,2-d]pyrimidine-6-carbaldehyde2-Chloro4morpholin-4-yl-thieno[3,2-d]pyrimidine-6carbaldehyde2-Chloro-4-morpholin-4-yl-thieno[3,2-d]pyrimidine-6-carbaldehydeBCP346692-Chloro-4-morpholinotThieno[3,2-d]pyrimidine-6-carboxaldehyde, 2-chloro-4-(4-morpholinyl)-
Show more names
1295582-CHLORO-4-MORPHOLINOTHIENO[3,2-D]PYRIMIDINE-6-CARBALDEHYDE-52-Chloro-4-(Morpholin-4-yl)thieno[3,2-d]pyriMidine-6-carboxaldehyde
A861739SCHEMBL189813DTXSID80672148PFAKZIZFIXKDFP-UHFFFAOYSA-N2-Chloro-4-morpholino-thieno[3,2-d]pyrimidine-6-carbaldehydeCS-B00602-chloro-4-(4-morpholinyl)-Thieno[3,2-d]pyrimidine-6-carboxaldehydeAKOS015850415
Database identifiers
- CAS
885618-31-5- PubChem CID
- 45789985
- DTXSID
DTXSID80672148
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 83.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 317
Physicochemical properties
- Density
- 1.522 · 1.522±0.06 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- pka
- 2.91 · 2.91±0.40(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H332-H335
- Precautionary statements
- 280 · P280-P305+P351+P338-P310
Safety & regulation
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H332-H335
- Precautionary statements
- P280-P305+P351+P338-P310
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Downstream products
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Related reactions
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