Basic information
- CAS
1211534-10-9- Standard SMILES
CCOC(=O)c1sc(C2CCNCC2)nc1C- InChIKey
IONSEBNIOUBPRV-UHFFFAOYSA-N- Molecular formula
- C12H18N2O2S
- Average molar mass
- 254.35 g/mol
- Monoisotopic mass
- 254.10889899
Names & identifiers
- Preferred name
- Ethyl 4-methyl-2-(piperidin-4-yl)-1,3-thiazole-5-carboxylate
- IUPAC
- ethyl 4-methyl-2-piperidin-4-yl-1,3-thiazole-5-carboxylate
- English name
- ethyl 4-methyl-2-(piperidin-4-yl)thiazole-5-carboxylate
- Molecular formula
- C12H18N2O2S
- Molecular weight
- 254.35
Names & synonyms
1211534-10-9ethyl 4-methyl-2-(piperidin-4-yl)-1,3-thiazole-5-carboxylateethyl 4-methyl-2-(piperidin-4-yl)thiazole-5-carboxylateethyl 4-methyl-2-piperidin-4-yl-1,3-thiazole-5-carboxylateDTXSID301208846LYB53410AKOS015060066CS-0243537EN300-264959ethyl 4-methyl-2-(4-piperidyl)thiazole-5-carboxylateEthyl 4-methyl-2-(4-piperidinyl)-5-thiazolecarboxylateF1907-0723
Show more names
5-Thiazolecarboxylic acid, 4-methyl-2-(4-piperidinyl)-, ethyl ester
ethyl4-methyl-2-(piperidin-4-yl)-1,3-thiazole-5-carboxylate
Database identifiers
- CAS
1211534-10-9- PubChem CID
- 65720197
- DTXSID
DTXSID301208846
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 79.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 269
Physicochemical properties
- Boiling point
- 372.2 · 372.2±42.0 °C(Predicted)
- Density
- 1.155 · 1.155±0.06 g/cm3(Predicted)
- pka
- 9.74 · 9.74±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-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
- P280-P305+P351+P338
Chemistry & industry
Suppliers2 total
IFLAB-BB[email protected]
宝欧信特生物科技（苏州）有限公司51288865780 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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