CAS 34837-84-8 Methyl 2-(4-fluorophenyl)acetate (HCID 2733233)

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Basic information

CAS: 34837-84-8
Standard SMILES: COC(=O)Cc1ccc(F)cc1
InChIKey: AJPPKGMEHMXPMC-UHFFFAOYSA-N
Molecular formula: C9H9FO2
Average molar mass: 168.16 g/mol
Monoisotopic mass: 168.05865775

Names & identifiers

Preferred name: Methyl 2-(4-fluorophenyl)acetate
IUPAC: methyl 2-(4-fluorophenyl)acetate
English name: Methyl 4-fluorophenylacetate
Molecular formula: C9H9FO2
Molecular weight: 168.16

Names & synonyms

methyl 2-(4-fluorophenyl)acetate34837-84-8DTXSID90369799RefChem:353846DTXCID40320835642-792-6methyl 4-fluorophenylacetateMFCD00800608methyl (4-fluorophenyl)acetate4-Fluorophenylacetic acid methyl esterMethyl 4-fluorophenyl acetate(4-fluorophenyl)acetic acid methyl ester

Show more names

Methyl 2-(4-fluorophenyl)Methyl4-fluorophenylacetate,98%Methyl 4-fluorophenylacetate 98%

METHYL 4-FLUOROPHENYLACETATE, 99methyl(4-fluorophenyl)acetateBenzeneacetic acid, 4-fluoro-, methyl estermethyl-4-fluorphenylacetateMethyl p-fluorophenylacetatemethyl 4-fluorophenyl-acetateSCHEMBL378218AJPPKGMEHMXPMC-UHFFFAOYSA-N

Database identifiers

CAS: 34837-84-8
PubChem CID: 2733233
DTXSID: DTXSID90369799
EC Number: 642-792-6
Nikkaji: J1.281.575A

Properties

Computed structural properties

XLogP: 1.9
Topological polar surface area: 26.3 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 3
Heavy atoms: 12
Formal charge: 0
Complexity: 151

Physicochemical properties

Boiling point: 210 °C · 210°C (rough estimate)
Density: 1.141 · 1.1410 (estimate)
refractive index: 1.487 · 1.4870
storage temp.: Sealed in dry,Room Temperature
form: Liquid
color: Clear colorless to yellow
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319
Precautionary statements: 501 · P501-P270-P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313-P301+P312+P330
Risk Statements: 36 · 36/37/38
Safety Statements: 36 · 36/37/39-26
HS Code: 29153900 · 29153900

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (33.3%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 3 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (33.3%)

Safety data

hs_code: 29153900
risk_code: 36/37/38
Signal word: Warning
Symbol(GHS): GHS07
safety_code: 36/37/39-26
Hazard statements: H302-H315-H319
Precautionary statements: P501-P270-P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313-P301+P312+P330