CAS 7035-11-2 4-Chloro-2-(chloromethyl)-1-methoxybenzene (HCID 6946753)

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Basic information

CAS: 7035-11-2
Standard SMILES: COc1ccc(Cl)cc1CCl
InChIKey: UWRGQGVLSLNMLG-UHFFFAOYSA-N
Molecular formula: C8H8Cl2O
Average molar mass: 191.05 g/mol
Monoisotopic mass: 189.99522024

Names & identifiers

Preferred name: 4-Chloro-2-(chloromethyl)-1-methoxybenzene
IUPAC: 4-chloro-2-(chloromethyl)-1-methoxybenzene
English name: 4-Chloro-2-(chloromethyl)-1-methoxybenzene
Molecular formula: C8H8Cl2O
Molecular weight: 191.05

Names & synonyms

4-chloro-2-(chloromethyl)-1-methoxybenzene7035-11-2MFCD021822625-chloro-2-methoxybenzyl chloride4-chloro-2-(chloromethyl)-1-methoxy-benzene2-Methoxy-5-chlorobenzyl chloride; 4-Chloro-2-chloromethyl-1-methoxybenzeneBenzene, 4-chloro-2-(chloromethyl)-1-methoxy-5-chloro-o-anisyl chlorideSCHEMBL905352DTXSID30426178UWRGQGVLSLNMLG-UHFFFAOYSA-NCS-B1012

Show more names

SBB014940STK693402AKOS0011360624-chloro-2-chloromethyl-1-methoxybenzeneBS-293184-chloro-2-chloromethyl-1-methoxy-benzeneDB-123391ST4143483

Database identifiers

CAS: 7035-11-2
PubChem CID: 6946753
DTXSID: DTXSID30426178
EC Number: 876-929-8

Properties

Computed structural properties

XLogP: 2.9
Topological polar surface area: 9.2 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 2
Heavy atoms: 11
Formal charge: 0
Complexity: 119

Physicochemical properties

Symbol(GHS): 5 · GHS05
Signal word: Danger
Hazard statements: 314 · H314
Precautionary statements: 301 · P301+P330+P331-P303+P361+P353-P305+P351+P338
HS Code: 2909309090 · 2909309090