Basic information
- CAS
64353-29-3- Standard SMILES
CCc1ccc(CCN)cc1- InChIKey
XLJAVPNHXCHBPU-UHFFFAOYSA-N- Molecular formula
- C10H15N
- Average molar mass
- 149.23 g/mol
- Monoisotopic mass
- 149.12044948
Names & identifiers
- Preferred name
- 4-Ethylphenethylamine
- IUPAC
- 2-(4-ethylphenyl)ethanamine
- English name
- 4-Ethylphenethylamine
- Molecular formula
- C10H15N
- Molecular weight
- 149.23
Names & synonyms
4-Ethylphenethylamine64353-29-3DTXSID10214570RefChem:98910DTXCID40137061XLJAVPNHXCHBPU-UHFFFAOYSA-N2-(4-Ethylphenyl)ethanamine2-(4-Ethylphenyl)Ethan-1-Amine4-Ethyl-benzeneethanamineCHEMBL453206MFCD000797572-(4-ethylphenyl)ethylamine
Show more names
RARECHEM AL BW 04484-ethylphenylethylamine4-Ethylphenethylamine,97%4-ETHYLPHENETHYLAMINE 98%Benzeneethanamine, 4-ethyl-2-(4-ethylphenyl)ethylammonium
4-ethyl phenethylamineSCHEMBL4920NCIOpen2_0015994-Ethylphenethylamine, 97%2-(4-ethylphenyl)-ethylamine2-(4-ethylphenyl)ethanamine;2-(4-ethyl-phenyl) ethylamine2-(4-ethyl-phenyl)-ethylamine
Database identifiers
- CAS
64353-29-3- PubChem CID
- 144047
- DTXSID
DTXSID10214570- ChEMBL
CHEMBL453206- EC Number
- 622-967-3
- Nikkaji
- J2.197.266E
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 93
Physicochemical properties
- Boiling point
- 240 · 240-241 °C (lit.)
- Density
- 0.94 · 0.94
- bulk density
- 0.94 g/mL · 0.940g/mL
- refractive index
- 20 · n20/D 1.5230(lit.)
- storage temp.
- Store at Room Tem.
- pka
- 10.01 · 10.01±0.10(Predicted)
- Specific Gravity
- 0.93 · 0.93
- InChI
- 1S/C10H15N/c1-2-9-3-5-10(6-4-9)7-8-11/h3-6H,2,7-8,11H2,1H3
- InChIKey
- XLJAVPNHXCHBPU-UHFFFAOYSA-N
- SMILES
- CCc1ccc(CCN)cc1
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 5 · GHS05
- Signal word
- Danger
- Hazard statements
- 314 · H314
- Precautionary statements
- 280 · P280-P303+P361+P353-P304+P340+P310-P305+P351+P338-P363-P405
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]；H318 (95.1%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 41 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard information
Hazard Classes and CategoriesSkin Corr. 1B (100%)；Eye Dam. 1 (95.1%)
Safety data
- PPE
- Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
- wgk
- 3
- ridadr
- UN 2735 8/PG 2
- hs_code
- 29214900
- risk_code
- 34
- Signal word
- Danger
- Symbol(GHS)
- GHS05
- hazard_code
- C,Xi
- safety_code
- 26-36/37/39-45
- hazard_class
- IRRITANT, IRRITANT-HARMFUL
Chemistry & industry
Applications
Uses4-Ethylphenethylamine is present in the essential oil obtained from the stem bark extract of Psidium guajava.
General Description4-Ethylphenethylamine is present in the essential oil obtained from the stem bark extract of Psidium guajava.
Suppliers20 total
Syntechem Co.,Ltd[email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
赛默飞世尔科技（中国）有限公司800-810-5118 · [email protected]
Clearsynth Labs Limited+91-22-26355700 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 4008675858 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
武汉凯威斯科技有限公司027-67849912 · [email protected]
上海颖心实验室设备有限公司021-021-59178156 15300768757 · [email protected]
Related reactions
13 records
Compound notes
Loading…