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N'-(3,4-Dichlorophenyl)-N,N-diethylurea

HCID 84980
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Basic information

CAS
15545-50-3
Standard SMILES
CCN(CC)C(=O)Nc1ccc(Cl)c(Cl)c1
InChIKey
XENORHLEQQVHAP-UHFFFAOYSA-N
Molecular formula
C11H14Cl2N2O
Average molar mass
261.14 g/mol
Monoisotopic mass
260.0483185

Names & identifiers

Preferred name
N'-(3,4-Dichlorophenyl)-N,N-diethylurea
IUPAC
3-(3,4-dichlorophenyl)-1,1-diethylurea
English name
N'-(3,4-Dichlorophenyl)-N,N-diethylurea
Molecular formula
C11H14Cl2N2O
Molecular weight
261.15

Names & synonyms

N'-(3,4-Dichlorophenyl)-N,N-diethylureaRefChem:8203853-(3,4-dichlorophenyl)-1,1-diethylureaEthuronEturon15545-50-3Urea, 3-(3,4-dichlorophenyl)-1,1-diethyl-N/'-(3,4-Dichlorophenyl)-N,N-diethylureaUrea, N'-(3,4-dichlorophenyl)-N,N-diethyl-SCHEMBL8098465DTXSID30935215XENORHLEQQVHAP-UHFFFAOYSA-N
Show more names
AKOS001366579UPCMLD0ENAT5805371:001ST50544495N'-(3,4-Dichlorophenyl)-N,N-diethylurea #N-(3,4-dichlorophenyl)(diethylamino)carboxamideN'-(3,4-Dichlorophenyl)-N,N-diethylcarbamimidic acidZ55290918

Database identifiers

CAS
15545-50-3
PubChem CID
84980
DTXSID
DTXSID30935215
EC Number
688-813-2
Nikkaji
J104.947J

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
32.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
3
Heavy atoms
16
Formal charge
0
Complexity
234

Physicochemical properties

Symbol(GHS)
6 · GHS06
Signal word
Danger
Hazard statements
301 · H301
Precautionary statements
264 · 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 · 4 items

Danger

H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]

P264, P270, P301+P316, P321, P330, 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.

Hazard information

Hazard Classes and CategoriesAcute Tox. 3 (100%)

Safety data

Signal word
Danger
Symbol(GHS)
GHS06
Hazard statements
H301
Precautionary statements
P264-P270-P301+P310-P321-P330-P405-P501

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