2-((1-Phenylethyl)amino)ethan-1-ol

HCID 14909

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Basic information

CAS: 1331-41-5
Standard SMILES: CC(NCCO)c1ccccc1
InChIKey: GXIWMXAAPLZOBY-UHFFFAOYSA-N
Molecular formula: C10H15NO
Average molar mass: 165.23 g/mol
Monoisotopic mass: 165.1153641

Names & identifiers

Preferred name: 2-((1-Phenylethyl)amino)ethan-1-ol
IUPAC: 2-(1-phenylethylamino)ethanol
English name: 2-(1-PHENYL-ETHYLAMINO)-ETHANOL
Molecular formula: C10H15NO
Molecular weight: 165.23

Names & synonyms

1331-41-52-[(1-Phenylethyl)Amino]Ethan-1-OlDTXSID609279412-((1-Phenylethyl)amino)ethan-1-olRefChem:1060450DTXCID0013567196623-43-42-(1-Phenyl-ethylamino)-ethanol2-(1-phenylethylamino)ethanol2-((1-Phenylethyl)amino)ethanol2-[(1-phenylethyl)amino]ethanol2-(.alpha.-Methybenzylamino)ethanol

Show more names

2-(α-Methylbenzylamino)ethanol2-[(α-Methylbenzyl)amino]ethanolN-(ALPHA-METHYLBENZYL)MONOETHANOLAMINE

((alpha-Methylbenzyl)amino)ethanolN-Hydroxyethyl-alpha-methylbenzylamine(R)-(+)-N-(2-HYDROXYETHYL)-ALPHA-PHENYLETHYLAMINEETHANOL, ((alpha-METHYLBENZYL)AMINO)-NSC54968MFCD00045973SCHEMBL3041726SCHEMBL3158749

Database identifiers

CAS: 1331-41-5、6623-43-4
PubChem CID: 14909
DTXSID: DTXSID60927941
EC Number: 678-922-3
Nikkaji: J78.162B

Properties

Computed structural properties

XLogP: 1
Topological polar surface area: 32.3 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 2
Rotatable bonds: 4
Heavy atoms: 12
Formal charge: 0
Complexity: 110

Physicochemical properties

Boiling point: 293.09 °C · 293.09°C (rough estimate)
Density: 1.0203 · 1.0203 (rough estimate)
refractive index: 1.52 · 1.5200 (estimate)
Hazard Codes: Xi,T
Risk Statements: 25 · 25-36
Safety Statements: 26 · 26-45
HazardClass: IRRITANT

Safety & regulation

GHS classification

GHS Classification · 4 items

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)

Aggregated GHS information provided per 4 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.