4-Chloro-2-methylanisole
Completing data — refresh the page later to see the latest
Basic information
- CAS
3260-85-3- Standard SMILES
COc1ccc(Cl)cc1C- InChIKey
VDYDAUQHTVCCBX-UHFFFAOYSA-N- Molecular formula
- C8H9ClO
- Average molar mass
- 156.61 g/mol
- Monoisotopic mass
- 156.03419259
Names & identifiers
- Preferred name
- 4-Chloro-2-methylanisole
- IUPAC
- 4-chloro-1-methoxy-2-methylbenzene
- English name
- 4-Chloro-2-methylanisole
- Molecular formula
- C8H9ClO
- Molecular weight
- 156.61
Names & synonyms
4-Chloro-2-methylanisole5-Chloro-2-methoxytoluene2-Methyl-4-Chloroanisole4-Chloro-2-methyl anisoleBenzene, 4-chloro-1-methoxy-2-methyl-DTXSID6041507NSC 3008827G3KQ2A26KDTXCID4021507EINECS 221-860-5NSC-300882CHLORO-2-METHYLANISOLE, 4-
Show more names
4-chloro-2-methyl4-CHLORO-2-METHYLANISOLE 97%4-Chloro-2-methylanisole,99%5-Chloro-2-methoxytoluene >4-Chloro-2-methyl-1-methoxybenzene1-Methoxy-2-methyl-4-chlorobenzene
ANISOLE, 4-CHLORO-2-METHYL-2-METHYL-4-CHLOROPHENYL METHYL ETHERRefChem:521134221-860-53260-85-34-chloro-1-methoxy-2-methylbenzeneMFCD00070771A821337
Database identifiers
- CAS
3260-85-3- PubChem CID
- 76748
- DTXSID
DTXSID6041507- ChEMBL
CHEMBL3187117- UNII
- 7G3KQ2A26K
- EC Number
- 221-860-5
- Nikkaji
- J262.359E
Properties
Computed structural propertiesFilling in
- XLogP
- 3.4
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 105
Experimental & physicochemical properties
SpringerMaterials PropertiesNuclear quadrupole resonance spectroscopy
Physicochemical properties
- Melting point
- 36 · 36-39 °C(lit.)
- Boiling point
- 104 °C/20mm · 104°C/20mm
- Density
- 1.095 · 1.0950 (rough estimate)
- refractive index
- 1.5345 · 1.5345-1.5365
- Flash point
- 215 °F · 215 °F
- storage temp.
- Sealed in dry,Room Temperature
- form
- Liquid After Melting
- color
- Clear colorless to slightly yellow
- CAS DataBase Reference
- 3260 · 3260-85-3(CAS DataBase Reference)
- FDA UNII
- 7 G3KQ2A26K · 7G3KQ2A26K
- EPA Substance Registry System
- 4 · 4-Chloro-2-methyl anisole (3260-85-3)
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
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 45 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- wgk
- 3
- hs_code
- 29093038
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36-24/25
- hazard_class
- IRRITANT
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P280a-P304+P340-P405-P501a-P261-P305+P351+P338-P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
6 records
Compound notes
Loading…