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1-(2-(N,N-Bis-(2-hydroxypropyl)-amino)-ethyl)-4-(2-hydroxypropyl)-piperazine

HCID 98117
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Basic information

CAS
3768-41-0
Standard SMILES
CC(O)CN1CCN(CCN(CC(C)O)CC(C)O)CC1
InChIKey
CVGZYBYVLMNLGK-UHFFFAOYSA-N
Molecular formula
C15H33N3O3
Average molar mass
303.44 g/mol
Monoisotopic mass
303.25219192

Names & identifiers

Preferred name
1-(2-(N,N-Bis-(2-hydroxypropyl)-amino)-ethyl)-4-(2-hydroxypropyl)-piperazine
IUPAC
1-[4-[2-[bis(2-hydroxypropyl)amino]ethyl]piperazin-1-yl]propan-2-ol
English name
1-(2-(N,N-BIS-(2-HYDROXYPROPYL)-AMINO)-ETHYL)-4-(2-HYDROXYPROPYL)-PIPERAZINE
Molecular formula
C15H33N3O3
Molecular weight
303.44

Names & synonyms

1-(2-(N,N-Bis-(2-Hydroxypropyl)-Amino)-Ethyl)-4-(2-Hydroxypropyl)-PiperazineRefChem:421303621-853-03768-41-01-(2-(N,N-Bis(2-hydroxypropyl)amino)ethyl)-4-(2-hydroxypropyl)piperazine1-[4-[2-[bis(2-hydroxypropyl)amino]ethyl]piperazin-1-yl]propan-2-ol1-[2-[N,N-Bis(2-hydroxypropyl)amino]ethyl]-4-(2-hydroxypropyl)piperazineNSC 78475BRN 4294160NSC78475S 35875-4Piperazine, 1-(2-(N,N-bis(2-hydroxypropyl)amino)ethyl)-4-(2-hydroxypropyl)-
Show more names
1-(2-Hydroxypropyl)-4-[2-[bis(2-hydroxypropyl)amino]ethyl]piperazine1-Piperazineethanol, 4-[2-[bis(2-hydroxypropyl)amino]ethyl]-α-methyl-1-Piperazineethanol, 4-(2-(bis(2-hydroxypropyl)amino)ethyl)-alpha-methyl- (9ci)
SCHEMBL3669437DTXSID10958720NSC-784751-Piperazineethanol, 4-(2-(bis(2-hydroxypropyl)amino)ethyl)-alpha-methyl-1-Piperazineethanol, 4-[2-[bis(2-hydroxypropyl)amino]ethyl]-.alpha.-methyl-AKOS024323094ST50443274WLN: T6N DNTJ A2N1YQ1&1YQ1 D1YQ1

Database identifiers

CAS
3768-41-0
PubChem CID
98117
DTXSID
DTXSID10958720
EC Number
621-853-0
Nikkaji
J117.718D

Properties

Computed structural propertiesFilling in

XLogP
-0.6
Topological polar surface area
70.4 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
6
Rotatable bonds
9
Heavy atoms
21
Formal charge
0
Complexity
263

Physicochemical properties

EWG's Food Scores
1 · 1
Symbol(GHS)
6 · GHS06
Signal word
Danger
Hazard statements
301 · H301-H315-H319-H335
Precautionary statements
264 · P264-P270-P301+P310-P321-P330-P405-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P

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 · 4 items

Danger

H301 (100%): 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 39 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 (100%)

Safety data

Signal word
Danger
Symbol(GHS)
GHS06
Hazard statements
H301-H315-H319-H335
Precautionary statements
P264-P270-P301+P310-P321-P330-P405-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P

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Compound notes

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