Basic information
- CAS
885950-68-5- Standard SMILES
CNC(CN1CCN(C)CC1)c1ccccc1- InChIKey
KFLLDKIXAMGZLH-UHFFFAOYSA-N- Molecular formula
- C14H23N3
- Average molar mass
- 233.35 g/mol
- Monoisotopic mass
- 233.18919775
Names & identifiers
- Preferred name
- [2-(4-Methylpiperazinyl)-1-phenylethyl]methylamine
- IUPAC
- N-methyl-2-(4-methylpiperazin-1-yl)-1-phenylethanamine
- English name
- [2-(4-METHYLPIPERAZINYL)-1-PHENYLETHYL]METHYLAMINE
- Molecular formula
- C14H23N3
- Molecular weight
- 233.36
Names & synonyms
885950-68-5[2-(4-methylpiperazinyl)-1-phenylethyl]methylamineN-methyl-2-(4-methylpiperazin-1-yl)-1-phenylethanamineN-Methyl-2-(4-methylpiperazin-1-yl)-1-phenylethan-1-amineMFCD01862535methyl[2-(4-methylpiperazin-1-yl)-1-phenylethyl]amineN-methyl-2-(4-methylpiperazin-1-yl)-1-phenyl-ethanamineN,4-Dimethyl-a-phenyl-1-piperazineethanamine 3HClSCHEMBL1541502DTXSID301008250AR3548AKOS005946728
Show more names
1-Piperazineethanamine, N,4-dimethyl-α-phenyl-METHYL-[2-(4-METHYL-PIPERAZIN-1-YL)-1-PHENYL-ETHYL]-AMINEn-methyl-2-(4-methylpiperazin-1-yl)-1-phenylethan-1-amine trihydrochloride
AS-45634DB-078007CS-0172461F306536
Database identifiers
- CAS
885950-68-5- PubChem CID
- 3776972
- DTXSID
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 206
Physicochemical properties
- Boiling point
- 336 · 336.0±32.0 °C(Predicted)
- Density
- 1.001 · 1.001±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 9.43 · 9.43±0.20(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501
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-H335
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501
Chemistry & industry
Suppliers19 total
广州诚创生物科技有限公司18027266590 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
北京炎礼生物科技有限公司18600731423 · [email protected]
北京亿思研科技开发中心010-56645598 13366904824 · [email protected]
Young Lively PharminBlock Co.,Ltd18600731423 · [email protected]
天津林宸科技有限公司15122256084 15122256084 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 4008675858 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
武汉开诺医药科技有限公司18040571231/1402788087
上海拓目化工有限公司13391076197 · [email protected]
凯试（上海）科技有限公司021-50135380 · [email protected]
泰迩生物医药泰州有限公司052386810091 · [email protected]
上海新平精细化学品有限公司18221735425 · [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]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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