(S)-1-(4-Fluorophenyl)-ethylamine

HCID 2779063
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Basic information

CAS
66399-30-2
Standard SMILES
C[C@H](N)c1ccc(F)cc1
InChIKey
QGCLEUGNYRXBMZ-LURJTMIESA-N
Molecular formula
C8H10FN
Average molar mass
139.17 g/mol

Names & identifiers

Preferred name
(S)-1-(4-Fluorophenyl)-ethylamine
IUPAC
(1S)-1-(4-fluorophenyl)ethanamine
English name
(S)-1-(4-Fluorophenyl)ethylamine
Molecular formula
C8H10FN
Molecular weight
139.17

Names & synonyms

66399-30-2(S)-1-(4-fluorophenyl)-ethylamineRefChem:407778679-261-3(S)-1-(4-fluorophenyl)ethanamine(S)-1-(4-Fluorophenyl)ethylamine(1S)-1-(4-fluorophenyl)ethanamine(S)-1-(4-FLUORO-PHENYL)-ETHYLAMINE(S)-(-)-1-(4-Fluorophenyl)EthylamineMFCD03092999(1S)-1-(4-fluorophenyl)ethan-1-amine(S)-4-Fluoro-alpha-methylbenzylamine
Show more names
(S)-1-(4-fluorophenyl)ethan-1-amineS-PF-PEM(S)-(-)-4-F-phenylethylamine1(S)-(4-Fluorophenyl)ethylamine(S)-α-Methyl-4-fluorobenzylaMine(s)-4-fluoro-à-methylbenzylamine(S)-4-Fluoro-α-methylbenzylamine
(1S)-1-(4-Fluorophenyl)ethylamineSCHEMBL56723SCHEMBL3877911QGCLEUGNYRXBMZ-LURJTMIESA-N(5)-1-(4-fluorophenyl)ethanamineCS-D0021(S)-1-(4-fluoro-phenyl)ethylamine(s)-p-fluoro-alpha-methylbenzylamine

Database identifiers

CAS
66399-30-2
PubChem CID
2779063
EC Number
679-261-3
Nikkaji
J1.372.615I

Properties

Computed structural properties

XLogP
1.3
Topological polar surface area
26 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
10

Physicochemical properties

Melting point
-30 °C · -30°C
Boiling point
76 °C · 76°C 22mm
Density
1 · 1,03 g/cm3
refractive index
1.501 · 1.501
Flash point
76 °C/22mm · 76°C/22mm
storage temp.
2 · under inert gas (nitrogen or Argon) at 2–8 °C

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H302 (88.6%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P264, P270, P273, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P363, P391, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 44 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (88.6%)

Safety data

ridadr
2735
hs_code
2921490090
risk_code
34-51/53-22
Signal word
Danger
Symbol(GHS)
GHS05,GHS07,GHS09
hazard_code
Xi,N,C

Chemistry & industry

Applications

Uses(S)-(-)-1-(4-Fluorophenyl)ethylamine is used in organic synthesis. It acts as a ligand and form a coordination complex, diacetato-2-O-bis[(S)-1-(4-fluorophenyl)ethylamine-N]palladium(II) by reacting with palladium(II) acetate.

Upstream & downstream products

Suppliers72 total

阿诺西（上海）生物技术有限公司400-1107768 15058188853 · [email protected]
南京优氟医药科技有限公司025-86755008 17751752005 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
北京依凯诺医药技术开发有限公司18518619637 · [email protected]

Related reactions

84 records
New reaction record

Compound notes

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