Basic information
- CAS
690631-99-3- Standard SMILES
OCc1ccc(N2CCCCC2)nc1- InChIKey
VLAMDMADWWGEDH-UHFFFAOYSA-N- Molecular formula
- C11H16N2O
- Average molar mass
- 192.26 g/mol
- Monoisotopic mass
- 192.12626314
Names & identifiers
- Preferred name
- 6-Piperidin-1-yl-3-(hydroxymethyl)pyridine
- IUPAC
- (6-piperidin-1-yl-3-pyridinyl)methanol
- English name
- (PIPERIDINO-3-PYRIDINYL)METHANOL
- Molecular formula
- C11H16N2O
- Molecular weight
- 192.26
Names & synonyms
690631-99-36-Piperidin-1-yl-3-(hydroxymethyl)pyridine[6-(piperidin-1-yl)pyridin-3-yl]methanol(6-piperidin-1-ylpyridin-3-yl)methanol(6-(Piperidin-1-yl)pyridin-3-yl)methanolMFCD05865147SCHEMBL987818orb3169995DTXSID10383417Fr12765SBB091476(6-piperidyl-3-pyridyl)methan-1-ol
Show more names
Compound Fr12765BUTTPARK 99\04-95(PIPERIDINO-3-PYRIDINYL)METHANOL(6-piperidino-3-pyridinyl)methanol6-PIPERIDINE-3-HYDROXYMETHYLPYRIDINE6-(1-Piperidinyl)-3-pyridinemethanol3-Pyridinemethanol, 6-(1-piperidinyl)5-(Hydroxymethyl)-2-(piperidin-1-yl)pyridine
[6-(1-piperidyl)-3-pyridyl]methanolAKOS009158855MS-22222CS-0370863
Database identifiers
- CAS
690631-99-3- PubChem CID
- 2794792
- DTXSID
DTXSID10383417
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 36.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 169
Physicochemical properties
- Melting point
- 70 °C · 70 °C
- Boiling point
- 388.4 · 388.4±32.0 °C(Predicted)
- Density
- 1.139 · 1.139±0.06 g/cm3(Predicted)
- pka
- 13.65 · 13.65±0.10(Predicted)
- CAS DataBase Reference
- 690631 · 690631-99-3
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302+H312+H332-H315-H319-H335
- Precautionary statements
- 280 · P280
- Hazard Codes
- Xi
- Hazard Note
- Irritant
- HS Code
- 2933399990 · 2933399990
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
- 2933399990
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_note
- Irritant
- Hazard statements
- H302+H312+H332-H315-H319-H335
- Precautionary statements
- P280
Chemistry & industry
Suppliers7 total
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
赛默飞世尔科技（中国）有限公司800-810-5118 · [email protected]
九鼎化学（上海）科技有限公司4009209199 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
合肥钼凯医药科技有限公司18130062233 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [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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