Basic information
- CAS
261178-24-9- Standard SMILES
OCc1ccccc1N1CCN(Cc2ccccc2)CC1- InChIKey
XMNZIYACKKYLJK-UHFFFAOYSA-N- Molecular formula
- C18H22N2O
- Average molar mass
- 282.4 g/mol
- Monoisotopic mass
- 282.17321333
Names & identifiers
- Preferred name
- [2-(4-Benzylpiperazin-1-yl)phenyl]methanol
- IUPAC
- [2-(4-benzylpiperazin-1-yl)phenyl]methanol
- English name
- [2-(4-BENZYLPIPERAZIN-1-YL)PHENYL]METHANOL
- Molecular formula
- C18H22N2O
- Molecular weight
- 282.38
Names & synonyms
[2-(4-benzylpiperazin-1-yl)phenyl]methanol261178-24-9Benzenemethanol, 2-[4-(phenylmethyl)-1-piperazinyl]-MFCD01764934(2-(4-benzylpiperazin-1-yl)phenyl)methanol2-(4-N-Benzylpiperazinyl)benzyl alcoholMaybridge1_008268Oprea1_530514SCHEMBL2454168HMS564P18DTXSID90372440XMNZIYACKKYLJK-UHFFFAOYSA-N
Show more names
RARECHEM AL BD 0460
AKOS009247201GS-6065SY317209DB-001448[2-(4-Benzyl-1-piperazinyl)phenyl]methanolCS-0156284F077734
Database identifiers
- CAS
261178-24-9- PubChem CID
- 2741998
- DTXSID
DTXSID90372440
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 26.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 296
Physicochemical properties
- Boiling point
- 445.6 · 445.6±45.0 °C(Predicted)
- Density
- 1.153 · 1.153±0.06 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- pka
- 14.28 · 14.28±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- Hazard Codes
- N
- Risk Statements
- 50 · 50
- Safety Statements
- 61 · 61
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
- risk_code
- 50
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- N
- safety_code
- 61
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Suppliers28 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
上海瀚麟生物科技有限公司183-0212-4410 18302124410 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海超悦化学科技有限公司（原上海斯比德化学）21-65679720 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
上海馨远医药科技有限公司021-24206007 13764915196 · [email protected]
武汉峰耀同辉化学制品有限公司027-87466205 15377579727 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
南京世洲生物科技有限公司025-85563444 18351873721 · [email protected]
上海瀚思化工有限公司18916268197 · [email protected]
烟台盛凯伦化学科技有限公司
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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