(R)-(1-(3-Chlorobenzyl)piperazin-2-yl)methanol
Basic information
- CAS
1263286-37-8- Standard SMILES
OC[C@H]1CNCCN1Cc1cccc(Cl)c1- InChIKey
FSVACMCTFSIBDE-GFCCVEGCSA-N- Molecular formula
- C12H17ClN2O
- Average molar mass
- 240.73 g/mol
- Monoisotopic mass
- 240.1029409
Names & identifiers
- Preferred name
- (R)-(1-(3-Chlorobenzyl)piperazin-2-yl)methanol
- IUPAC
- [(2R)-1-[(3-chlorophenyl)methyl]piperazin-2-yl]methanol
- English name
- 2-Piperazinemethanol, 1-[(3-chlorophenyl)methyl]-, (2R)-
- Molecular formula
- C12H17ClN2O
- Molecular weight
- 240.73
Names & synonyms
(R)-(1-(3-Chlorobenzyl)piperazin-2-yl)methanol1263286-37-8[(2R)-1-[(3-chlorophenyl)methyl]piperazin-2-yl]methanol{(2R)-1-[(3-Chlorophenyl)methyl]piperazin-2-yl}methanolDTXSID80677491AKOS015899163[(2R)-1-(3-Chlorobenzyl)-2-piperazinyl]methanol, AldrichCPR(S)-(1-(3-chlorobenzyl)piperazin-2-yl)Methanol(2R)-1-[(3-Chlorophenyl)methyl]-2-piperazinemethanol[(2R)-1-[(3-chlorophenyl)Methyl]piperazin-2- yl]Methanol2-Piperazinemethanol, 1-[(3-chlorophenyl)methyl]-, (2R)-
Database identifiers
- CAS
1263286-37-8- PubChem CID
- 46941865
- DTXSID
DTXSID80677491
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 215
Physicochemical properties
- Boiling point
- 368.006 · 368.006±27.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.19 · 1.190±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 14.966 · 14.966±0.10(predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
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
- H315-H319
- Precautionary statements
- P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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