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1-Allyl-3-(2,5-dichlorophenoxy) urea (HCID 13746372)|Huagongshe
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Compound
1-Allyl-3-(2,5-dichlorophenoxy) urea
HCID
13746372
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Basic information
Names & identifiers
Properties
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Compound notes
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Basic information
Standard SMILES
C=CCNC(=O)NOc1cc(Cl)ccc1Cl
InChIKey
UQBVVQIXARIFCP-UHFFFAOYSA-N
Molecular formula
C10H10Cl2N2O2
Average molar mass
261.1 g/mol
Names & identifiers
Preferred name
1-Allyl-3-(2,5-dichlorophenoxy) urea
IUPAC
1-(2,5-dichlorophenoxy)-3-prop-2-enylurea
Names & synonyms
SCHEMBL9730736
UQBVVQIXARIFCP-UHFFFAOYSA-N
1-Allyl-3-(2,5-dichlorophenoxy) urea
Database identifiers
PubChem CID
13746372
Properties
Computed structural properties
XLogP
3.1
Topological polar surface area
50.4 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
16
Formal charge
0
Complexity
251
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Related reactions
2 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
116013
As product
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID
1195604
As product
uspto-grants-1992_05
Compound notes
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