Basic information
- CAS
1074-54-0- Standard SMILES
CC(O)CN1CCNCC1- InChIKey
XAKIZRLIXGLPBW-UHFFFAOYSA-N- Molecular formula
- C7H16N2O
- Average molar mass
- 144.21 g/mol
- Monoisotopic mass
- 144.12626313
Names & identifiers
- Preferred name
- alpha-Methyl-1-piperazineethanol
- IUPAC
- 1-piperazin-1-ylpropan-2-ol
- English name
- alpha-methylpiperazine-1-ethanol
- Molecular formula
- C7H16N2O
- Molecular weight
- 144.21474
Names & synonyms
1074-54-0alpha-Methyl-1-piperazineethanolRefChem:3184371-(piperazin-1-yl)propan-2-ol1-(1-piperazinyl)-2-propanol1-piperazin-1-yl-propan-2-ol1-piperazin-1-ylpropan-2-olalpha-Methylpiperazine-1-ethanolMFCD00130195NSC869632-hydroxypropyl piperazineNCIOpen2_001117
Show more names
Einecs 214-042-4α-Methyl-1-piperazineethanol1-Piperazineethanol, α-methyl-1-Piperazineethanol, a-methyl-
?-methylpiperazine-1-ethanolSCHEMBL154268SCHEMBL1372330SCHEMBL1394111SCHEMBL6243364SCHEMBL10667505SCHEMBL10667510I+/--Methyl-1-piperazineethanol
Database identifiers
- CAS
1074-54-0- PubChem CID
- 258198
- DTXSID
DTXSID801308940- EC Number
- 214-042-4
- Nikkaji
- J217.191K
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 91.6
Physicochemical properties
- Boiling point
- 108.5 °C · 108.5 °C(Press: 10 Torr)
- Density
- 1.0103 g/cm3 · 1.0103 g/cm3
- storage temp.
- Store at Room Tem.
- pka
- 15.03 · 15.03±0.20(Predicted)
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Danger
- Hazard statements
- 301 · H301
- Precautionary statements
- 301 · P301+P310
- Hazard Codes
- T
- Risk Statements
- 25 · 25
- Safety Statements
- 45 · 45
- WGK Germany
- 3 · 3
Safety & regulation
GHS classification
GHS Classification
Danger
H301 (50%): Toxic if swallowed [Danger Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 3 (50%)
Safety data
- wgk
- 3
- risk_code
- 25
- Signal word
- Danger
- Symbol(GHS)
- GHS06
- hazard_code
- T
- safety_code
- 45
- Hazard statements
- H301
- Precautionary statements
- P301+P310
Chemistry & industry
Suppliers13 total
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海康恩博科技有限公司（科小研试剂）400-1388-521 17673770086 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
Shanghai Hanhong Scientific Co., Ltd.+undefined17612118332 · [email protected]
陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海瀚思化工有限公司17717618050 · [email protected]
合肥钼凯医药科技有限公司18130062233 · [email protected]
淮安海玻瑞恩医药研发有限公司18114966287 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 15955137747 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海捷世凯生物科技有限公司021-57520305 13795461237 · [email protected]
Related reactions
6 records
Compound notes
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