Basic information
- CAS
2842-37-7- Standard SMILES
OCCNCCc1ccccc1- InChIKey
WPOHVHKEDGUEPZ-UHFFFAOYSA-N- Molecular formula
- C10H15NO
- Average molar mass
- 165.23 g/mol
- Monoisotopic mass
- 165.1153641
Names & identifiers
- Preferred name
- N-Phenethylethanolamine
- IUPAC
- 2-(2-phenylethylamino)ethanol
- English name
- 2-(Phenethylamino)ethanol
- Molecular formula
- C10H15NO
- Molecular weight
- 165.23
Names & synonyms
2-(phenethylamino)ethanol2842-37-7ETHANOL, 2-(PHENETHYLAMINO)-N-Phenethylethanolamine2-PhenylethylaminoethanolEthanol, 2-((phenethyl)amino)-2ZLO6CQ5VIEthanol, 2-((2-phenylethyl)amino)-Ethanol, 2-[(2-phenylethyl)amino]-NSC 194893BRN 2084395UNII-2ZLO6CQ5VI
Show more names
2-(Phenethylamino)ethan-1-ol2-[(2-Phenylethyl)amino]ethan-1-ol
NSC-194893DTXSID401826324-12-00-02459 (Beilstein Handbook Reference)2-((2-PHENYLETHYL)AMINO)ETHANOL2-[(2-phenylethyl)amino]EthanolEthanol, 2-[(phenethyl)amino]-RefChem:164103DTXCID80105123
Database identifiers
- CAS
2842-37-7- PubChem CID
- 17826
- DTXSID
DTXSID40182632- UNII
- 2ZLO6CQ5VI
- EC Number
- 862-305-2
- Nikkaji
- J34.771J
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 100
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)
- pka
- 14.78 · 14.78±0.10(Predicted)
- FDA UNII
- 2 ZLO6CQ5VI · 2ZLO6CQ5VI
- Symbol(GHS)
- 7 · GHS07,GHS05
- Signal word
- Danger
- Hazard statements
- 314 · H314-H335-H302
- Precautionary statements
- 260 · P260-P264-P280-P301+P330+P331-P303+P361+P353-P363-P304+P340-P310-P321-P305+P351+P338-P405-P501-P264-P270-P301+P312-P330-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.
GHS classification
GHS Classification
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P330, P363, 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%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS05
- Hazard statements
- H314-H335-H302
- Precautionary statements
- P260-P264-P280-P301+P330+P331-P303+P361+P353-P363-P304+P340-P310-P321-P305+P351+P338-P405-P501-P264-P270-P301+P312-P330-P501
Chemistry & industry
Suppliers8 total
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
泰州市众致生物科技有限公司[email protected] 15066129350 · [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]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 13913916777 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
郑州灏德医药科技有限公司18037386321 · [email protected]
北京新研汇医药研发有限公司13969155946 · [email protected]
Related reactions
8 records
Compound notes
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