Phenethylamine (CAS 64-04-0) — formula C8H11N, molecular weight 121.09 g/mol.
| CAS Number | 64-04-0 |
|---|---|
| Molecular Formula | C8H11N |
| Molecular Weight | 121.09 g/mol |
| Melting Point | -60 |
| Boiling Point | 197.5 |
| LogP | 1.4 |
| Applications | Uses: Used for organic synthesis and as a lab reagent and scintillation counter (CO2 absorber), [HSDB] Similar to amphetamine in pharmacological properties, Present in oil of bitter almonds and normal human urine, [Merck Index] Used as a flavoring agent, [INCHEM], Organic synthesis, laboratory reagent, scintillation counter (CO2 absorber), Use Classification: Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Methods of Manufacturing:, Prepd by reducing benzyl cyanide with sodium and alc:, Johnson, Guest, Am. Chem. J. 42 346 (1909), or by reduction with raney nickel:, Robinson, Snyder, Org. Syn. Coll. Vol. III 720 (1955)., From phenylethyl alcohol and ammonia under pressure., Formulations, Preparations: Grades: Technical, scintillation., General Manufacturing Information: Benzeneethanamine: ACTIVE, beta-Phenylethylamine can be viewed as the parent compound of the sympathomimetic amines, consisting of a benzene ring and an ethylamine side chain. |
Documented applications: Uses: Used for organic synthesis and as a lab reagent and scintillation counter (CO2 absorber), [HSDB] Similar to amphetamine in pharmacological properties, Present in oil of bitter almonds and normal human urine, [Merck Index] Used as a flavoring agent, [INCHEM], Organic synthesis, laboratory reagent, scintillation counter (CO2 absorber), Use Classification: Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Methods of Manufacturing:, Prepd by reducing benzyl cyanide with sodium and alc:, Johnson, Guest, Am. Chem. J. 42 346 (1909), or by reduction with raney nickel:, Robinson, Snyder, Org. Syn. Coll. Vol. III 720 (1955)., From phenylethyl alcohol and ammonia under pressure., Formulations, Preparations: Grades: Technical, scintillation., General Manufacturing Information: Benzeneethanamine: ACTIVE, beta-Phenylethylamine can be viewed as the parent compound of the sympathomimetic amines, consisting of a benzene ring and an ethylamine side chain..
Phenethylamine is a chemical compound with CAS registry number 64-04-0 and molecular formula C8H11N (molecular weight 121.09 g/mol).
CAS number: 64-04-0
Its molecular formula C8H11N comprises 8 C, 11 H, 1 N atoms.
Also known as: Phenethylamine · 苯乙胺
The CAS registry number of Phenethylamine is 64-04-0.
Molecular formula C8H11N, molecular weight 121.09 g/mol.
It is also registered under: Phenethylamine, 苯乙胺.
Recorded applications: Uses: Used for organic synthesis and as a lab reagent and scintillation counter (CO2 absorber), [HSDB] Similar to amphetamine in pharmacological properties, Present in oil of bitter almonds and normal human urine, [Merck Index] Used as a flavoring agent, [INCHEM], Organic synthesis, laboratory reagent, scintillation counter (CO2 absorber), Use Classification: Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Methods of Manufacturing:, Prepd by reducing benzyl cyanide with sodium and alc:, Johnson, Guest, Am. Chem. J. 42 346 (1909), or by reduction with raney nickel:, Robinson, Snyder, Org. Syn. Coll. Vol. III 720 (1955)., From phenylethyl alcohol and ammonia under pressure., Formulations, Preparations: Grades: Technical, scintillation., General Manufacturing Information: Benzeneethanamine: ACTIVE, beta-Phenylethylamine can be viewed as the parent compound of the sympathomimetic amines, consisting of a benzene ring and an ethylamine side chain..
Independent reference data for Phenethylamine (CAS 64-04-0), compiled from public chemistry databases.
| CAS 号 | 64-04-0 |
|---|---|
| PubChem CID | 1001 |
| 分子式 | C8H11N |
| 分子量 | 121.09 g/mol |
| IUPAC 名称 | 2-phenylethanamine |
| InChIKey | BHHGXPLMPWCGHP-UHFFFAOYSA-N |
| UNII（FDA） | 327C7L2BXQ |
| ChEBI 编号 | CHEBI:18397 |
| FEMA 编号 | 3220 |
| JECFA 编号 | 1589 |
| Molecular Weight | 121.18 |
|---|---|
| XLogP3 | 1.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 2 |
| Exact Mass | 121.089149355 |
| Monoisotopic Mass | 121.089149355 |
| Topological Polar Surface Area | 26 |
| Heavy Atom Count | 9 |
| Boiling Point | 197.5 |
|---|---|
| Boiling Point | 197.5 °C |
| Boiling Point | BP: 194.5-195 °C |
| Boiling Point | BP: 204 °C |
| Boiling Point | 194.00 to 195.00 °C. @ 760.00 mm Hg |
| Boiling Point | 194-195 °C |
| Melting Point | -60 |
| Melting Point | <0 °C |
| Flash Point | 81 °C (178 °F) - closed cup |
| Density | 0.9640 g/cu cm at 25 °C |
Phenethylamine; 2-phenylethylamine; 2-Phenylethanamine; 2-Phenethylamine; beta-Phenethylamine; 1-Amino-2-phenylethane; beta-Aminoethylbenzene; (2-Aminoethyl)benzene; 1-Phenyl-2-aminoethane; 2-Amino-1-phenylethane; Ethanamine, 2-phenyl-; Ethylamine, 2-phenyl-; 1-Phenyl-2-amino-athan; 2-Fenylethylamin; 2-Amino-fenylethan; PHENETHYLAMINE, BETA
| 法规与食品接触 | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent No safety concern at current levels of intake when used as a flavouring agent TRS 934-JECFA 65/89 |
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| 已通报的危害声明 | H301 (12.8%), H302 (87.2%), H312 (87.1%), H314 (98.4%), H332 (86.7%), H227, H318, H290 |
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苯乙胺 的 CAS 号为 64-04-0，分子式 C8H11N，分子量 121.09 g/mol。 UNII 327C7L2BXQ; ChEBI 18397; InChIKey BHHGXPLMPWCGHP-UHFFFAOYSA-N. Boiling Point: 197.5; Boiling Point: 197.5 °C; Boiling Point: BP: 194.5-195 °C.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 苯乙胺