1-(4-Chlorobutoxy)-2-methylbenzene
Basic information
- CAS
50873-93-3- Standard SMILES
Cc1ccccc1OCCCCCl- InChIKey
GADHSOUSWKQCEU-UHFFFAOYSA-N- Molecular formula
- C11H15ClO
- Average molar mass
- 198.69 g/mol
- Monoisotopic mass
- 198.0811428
Names & identifiers
- Preferred name
- 1-(4-Chlorobutoxy)-2-methylbenzene
- IUPAC
- 1-(4-chlorobutoxy)-2-methylbenzene
- English name
- 1-(4-chlorobutoxy)-2-methylbenzene
- Molecular formula
- C11H15ClO
- Molecular weight
- 198.6892
Names & synonyms
1-(4-Chlorobutoxy)-2-methylbenzene83732-48-3EINECS 280-595-3DTXSID40965109NSC 75873RefChem:425192DTXCID701392786280-595-350873-93-34-Chlorobutyl o-tolyl etherEther, 4-chlorobutyl o-tolylNSC75873
Show more names
(4-chloro-butyl)-o-tolyl ether
Benzene,1-(4-chlorobutoxy)-2-methyl-Ether, 4-chlorobutyl o-tolyl,SCHEMBL6304558NSC-758731-(BENZYLOXY)-4-CHLOROBUTANEAKOS011019870DS-006702NS00058887
Database identifiers
- CAS
50873-93-3、83732-48-3- PubChem CID
- 96477
- DTXSID
DTXSID40965109- EC Number
- 280-595-3
- Nikkaji
- J296.160A
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 127
Physicochemical properties
- Symbol(GHS)
- 9 · GHS09,GHS06
- Signal word
- Danger
- Hazard statements
- 411 · H411-H319-H301
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P310-P321-P330-P405-P501
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
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P264, P264+P265, P270, P273, P280, P301+P316, P305+P351+P338, P321, P330, P337+P317, P391, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 3 (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS09,GHS06
- Hazard statements
- H411-H319-H301
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P310-P321-P330-P405-P501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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