N-Ethylbenzylamine
Basic information
- CAS
14321-27-8- Standard SMILES
CCNCc1ccccc1- InChIKey
HVAAHUDGWQAAOJ-UHFFFAOYSA-N- Molecular formula
- C9H13N
- Average molar mass
- 135.21 g/mol
- Monoisotopic mass
- 135.10479942
Names & identifiers
- Preferred name
- N-Ethylbenzylamine
- IUPAC
- N-benzylethanamine
- English name
- N-Ethylbenzylamine
- Molecular formula
- C9H13N
- Molecular weight
- 135.21
Names & synonyms
N-EthylbenzylamineN-benzylethanamineN-BenzylethylamineBenzenemethanamine, N-ethyl-EthylbenzylamineBenzylamine, N-ethyl-BenzylethylamineN-ethyl-N-benzylamineN-Benzyl-N-ethylamineethyl(phenylmethyl)aminen-ethylbenzenemethanamineBENZYL-ETHYL-AMINE
Show more names
NEBAEtilefrine Impurity FN-Ethylbenzylamine>
EINECS 238-265-1UNII-MM8324KE8VMM8324KE8V5417-36-7DTXSID7022259N-(PHENYLMETHYL)ETHYLAMINERefChem:163337DTXCID702259
Database identifiers
- CAS
14321-27-8- PubChem CID
- 84352
- DTXSID
DTXSID7022259- ChEMBL
CHEMBL1178178- UNII
- MM8324KE8V
- EC Number
- 238-265-1
- Nikkaji
- J270D
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 74.8
Experimental & physicochemical properties
SpringerMaterials PropertiesDielectric constant
LogP1.82
Physicochemical properties
- Melting point
- 191 · 191-194
- Boiling point
- 191 · 191-194 °C (lit.)
- Density
- 0.909 g/mL · 0.909 g/mL at 25 °C (lit.)
- refractive index
- 20 · n20/D 1.511(lit.)
- Flash point
- 152 °F · 152 °F
- storage temp.
- 2 · Keep in dark place,Sealed in dry,2-8°C
- solubility
- slightly soluble
- form
- Liquid
- pka
- 9.77 · 9.77±0.10(Predicted)
- color
- Clear colorless to slightly yellow
- Water Solubility
- slightly soluble
- Sensitive
- Air Sensitive
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
H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 51 reports by companies from 6 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory InformationStatus: Active Update: 14-11-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/21062
Hazard Classes and CategoriesSkin Corr. 1B (100%)
Safety data
- PPE
- Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN 2735 8/PG 3
- hs_code
- 29214980
- risk_code
- 34-37-52
- Signal word
- Danger
- Symbol(GHS)
- GHS05
- hazard_code
- C
- hazard_note
- Corrosive/Air Sensitive
- safety_code
- 26-36/37/39-45
- hazard_class
- 8
- Storage Class
- 8A - Combustible corrosive hazardous materials
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzenemethanamine, N-ethyl-: ACTIVE
Applications
UsesN-Ethylbenzylamine has been used to demonstrate the reactivity of NDTE (2,5-dihydroxyphenylacetic acid, 2,5-bis-tetrahydropyranyl ether p-nitrophenyl ester) and HLTE (homogentisic gamma-lactone tetrahydropyranyl ether). It has also been used to prepare 2-[(N-Benzyl, N-ethyl)amino]derivative using 2-chloro-4H-pyrido[1,2-a]pyrimidin-4-one.
Upstream & downstream products
Upstream raw materials
Downstream products
Related reactions
96 records
Compound notes
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