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2,4-Bis(chloromethyl)toluene

HCID 75952
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
2735-05-9
Standard SMILES
Cc1ccc(CCl)cc1CCl
InChIKey
HKCWYAWNOIYUAS-UHFFFAOYSA-N
Molecular formula
C9H10Cl2
Average molar mass
189.08 g/mol
Monoisotopic mass
188.0159557

Names & identifiers

Preferred name
2,4-Bis(chloromethyl)toluene
IUPAC
2,4-bis(chloromethyl)-1-methylbenzene
English name
2,4-bis(chloromethyl)toluene
Molecular formula
C9H10Cl2
Molecular weight
189.08

Names & synonyms

2,4-Bis(chloromethyl)toluene2735-05-9Benzene, 2,4-bis(chloromethyl)-1-methyl-Di(chloromethyl) tolueneDTXSID2062614EINECS 220-356-2RefChem:443077DTXCID4037663220-356-22,4-Bis(chloromethyl)-1-methylbenzenedi(Chloromethyl)toluene1-methyl-2,4-bis(chloromethyl)benzene
Show more names
2,4-Di[chloromethyl]toluene2,4- Bis(chlormethyl)toluolSCHEMBL55983642,4-Bis(chloromethyl)-1-methylbenzene #Benzene, 1,3-bis-(chloromethyl)-4-methylNS00048307

Database identifiers

CAS
2735-05-9
PubChem CID
75952
DTXSID
DTXSID2062614
EC Number
220-356-2
Nikkaji
J299.203E

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
2
Heavy atoms
11
Formal charge
0
Complexity
114

Physicochemical properties

EPA Substance Registry System
2 · 2,4-Bis(chloromethyl)toluene (2735-05-9)
TSCA
TSCA listed

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationBenzene, 2,4-bis(chloromethyl)-1-methyl-: INACTIVE

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes