Basic information
- Standard SMILES
ClCc1cccc(Cl)c1- InChIKey
DDGRAFHHXYIQQR-UHFFFAOYSA-N- Molecular formula
- C7H6Cl2
- Average molar mass
- 161.03 g/mol
Names & identifiers
- Preferred name
- m,alpha-Dichlorotoluene
- IUPAC
- 1-chloro-3-(chloromethyl)benzene
- English name
- Benzene, 1-chloro-3-(chloromethyl)-, radical ion(1-) (9CI)
- Molecular formula
- C7H6Cl2
- Molecular weight
- 161.03
Names & synonyms
3-Chlorobenzyl chloride620-20-21-Chloro-3-(chloromethyl)benzenealpha,3-DichlorotolueneBenzene, 1-chloro-3-(chloromethyl)-M-CHLOROBENZYL CHLORIDEm-Chlorbenzyl chloridem,alpha-DichlorotolueneDTXSID2057786Toluene, m,alpha-dichloro-QXH4Y96Y2LEINECS 210-629-4
Show more names
Benzene, 1-chloro-3-(chloromethyl)-, radical ion(1-) (9CI)
NSC 76577NSC-76577DTXCID30315751-Chloro-3-(chloromethyl)-benzeneRefChem:800323Toluene, m,alpha-dichloro-(8CI)210-629-43-Chlorobenzylchloride
Database identifiers
- CAS
130468-19-8- ChEMBL
CHEMBL3561692- UNII
- QXH4Y96Y2L
- EC Number
- 210-629-4
- Nikkaji
- J7.047E
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 1
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 83
Experimental & physicochemical properties
SpringerMaterials PropertiesDensity
Safety & regulation
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 1.4% (1 of 71) of reports.
Danger
H302 (25.4%): Harmful if swallowed [Warning Acute toxicity, oral]
P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P362+P364, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 71 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory InformationChemical: Benzene, 1-chloro-3-(chloromethyl)-
Hazard Classes and CategoriesAcute Tox. 4 (25.4%)
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzene, 1-chloro-3-(chloromethyl)-: ACTIVE
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Linked notes
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