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1,1-Dibutyl-3-(2,6-dichlorophenyl)urea

HCID 5082702
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Basic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
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Basic information

CAS
15442-06-5
Standard SMILES
CCCCN(CCCC)C(=O)Nc1c(Cl)cccc1Cl
InChIKey
FNQYBZQXGDBZDD-UHFFFAOYSA-N
Molecular formula
C15H22Cl2N2O
Average molar mass
317.3 g/mol
Monoisotopic mass
316.1109187

Names & identifiers

Preferred name
1,1-Dibutyl-3-(2,6-dichlorophenyl)urea
IUPAC
1,1-dibutyl-3-(2,6-dichlorophenyl)urea

Names & synonyms

1,1-dibutyl-3-(2,6-dichlorophenyl)urea15442-06-5RefChem:409773665-672-5AKOS024334689

Database identifiers

CAS
15442-06-5
PubChem CID
5082702
EC Number
665-672-5

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
32.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
7
Heavy atoms
20
Formal charge
0
Complexity
271

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 · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P264, P270, P273, P301+P317, P330, 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. 4 (100%)

Related reactions

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Compound notes

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