Basic information
- CAS
113826-40-7- Standard SMILES
COC(=O)C1CNCC(OC)C1- InChIKey
BPBNOXOFPXLREH-UHFFFAOYSA-N- Molecular formula
- C8H15NO3
- Average molar mass
- 173.21 g/mol
- Monoisotopic mass
- 173.10519334
Names & identifiers
- Preferred name
- Methyl 5-methoxypiperidine-3-carboxylate
- IUPAC
- methyl 5-methoxypiperidine-3-carboxylate
- English name
- methyl 5-methoxypiperidine-3-carboxylate
- Molecular formula
- C8H15NO3
- Molecular weight
- 173.21
Names & synonyms
methyl 5-methoxypiperidine-3-carboxylate113826-40-73-Piperidinecarboxylic acid, 5-methoxy-, methyl esterSCHEMBL1439809DTXSID50736246BPBNOXOFPXLREH-UHFFFAOYSA-Nmethyl5-methoxypiperidine-3-carboxylateSB15518DA-16671PS-16903CS-0056548P12833
Show more names
EN300-7423143
Database identifiers
- CAS
113826-40-7- PubChem CID
- 67033617
- DTXSID
DTXSID50736246- EC Number
- 190-859-9
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 47.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 160
Physicochemical properties
- Boiling point
- 227.9 · 227.9±40.0 °C(Predicted)
- Density
- 1.07 · 1.07±0.1 g/cm3(Predicted)
- pka
- 8.19 · 8.19±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
Suppliers6 total
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
海济医药科技（苏州）有限公司18012778619 · [email protected]
成都博科辰欣医药科技有限公司028-82393420 18108156287 · [email protected]
苏州海犇药业有限公司18012778619 · [email protected]
上海相辉医药科技有限公司13611835272 13611835272 · [email protected]
苏州泽郡生物科技有限公司13814894981 · [email protected]
Related reactions
2 records
Compound notes
Loading…