Basic information
- CAS
58110-73-9- Standard SMILES
NCCCN1CCN(CCO)CC1- InChIKey
BQQVEASFNMRTBA-UHFFFAOYSA-N- Molecular formula
- C9H21N3O
- Average molar mass
- 187.28 g/mol
- Monoisotopic mass
- 187.1684623
Names & identifiers
- Preferred name
- 1-Piperazineethanol, 4-(3-aminopropyl)-
- IUPAC
- 2-[4-(3-aminopropyl)piperazin-1-yl]ethanol
- English name
- NSC80665
- Molecular formula
- C9H21N3O
- Molecular weight
- 187.28
Names & synonyms
58110-73-91-piperazineethanol, 4-(3-aminopropyl)-2-[4-(3-Amino-propyl)-piperazin-1-yl]-ethanol2-[4-(3-aminopropyl)piperazin-1-yl]ethanolNSC80665SCHEMBL1559833SCHEMBL6160750DTXSID50973694BQQVEASFNMRTBA-UHFFFAOYSA-NKST-1A6204CCG-40369NSC-80665
Show more names
1-Piperazineethanol,4-(3-aminopropyl)-(7CI,9CI)
AKOS0026705192-[4-(3-aminopropyl)-1-piperazinyl]ethanol2-[4-(3-Aminopropyl)piperazin-1-yl]ethan-1-ol3-[4-(2-hydroxyethyl)-1-piperazinyl]propylamineN-(3-aminopropyl)-N'-(2-hydroxyethyl) piperazineN-(3-aminopropyl)-N'-(2-hydroxyethyl)piperazine(7r,8as)-2-methoxy-11-methyl-7,8,9,10,11,12-hexahydro-6h-[1]benzofuro[3a,3,2-ef][2]benzazepin-7-ol- pyridin-4-amine hydrobromide hydrochloride(1:1:1:1)
Database identifiers
- CAS
58110-73-9- PubChem CID
- 255283
- DTXSID
DTXSID50973694- EC Number
- 110-655-5
Properties
Computed structural properties
- XLogP
- -1.5
- Topological polar surface area
- 52.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 124
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, 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)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Chemistry & industry
Suppliers1 total
上海安米克化学品有限公司微信 18019252918 18019252918 · [email protected]
Related reactions
7 records
Compound notes
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