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1-(2-Benzoyl-4-chlorophenyl)-3-phenylurea

HCID 4423946
NotesReactions

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

CAS
25514-23-2
Standard SMILES
O=C(Nc1ccccc1)Nc1ccc(Cl)cc1C(=O)c1ccccc1
InChIKey
OKYIKPYUCUWSDO-UHFFFAOYSA-N
Molecular formula
C20H15ClN2O2
Average molar mass
350.8 g/mol
Monoisotopic mass
350.0822054

Names & identifiers

Preferred name
1-(2-Benzoyl-4-chlorophenyl)-3-phenylurea
IUPAC
1-(2-benzoyl-4-chlorophenyl)-3-phenylurea
English name
1-(2-Benzoyl-4-chlorophenyl)-3-phenylurea
Molecular formula
C20H15ClN2O2
Molecular weight
350.8

Names & synonyms

1-(2-benzoyl-4-chlorophenyl)-3-phenylureaRefChem:42154225514-23-2667-460-8SCHEMBL11390915OKYIKPYUCUWSDO-UHFFFAOYSA-NAKOS024431037Urea, N-(2-benzoyl-4-chlorophenyl)-N'-phenyl-

Database identifiers

CAS
25514-23-2
PubChem CID
4423946
EC Number
667-460-8

Properties

Computed structural propertiesFilling in

XLogP
5
Topological polar surface area
58.2 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
25
Formal charge
0
Complexity
459

Physicochemical properties

Hazard statements
413 · H413

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 · 3 items

H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]

P273, 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.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Hazard information

Hazard Classes and CategoriesAquatic Chronic 4 (100%)

Safety data

Hazard statements
H413

Chemistry & industry

Suppliers3 total

西格玛奥德里奇(上海)贸易有限公司21-20338288 · [email protected]
Sigma-Aldrich Japan K.K.[email protected]
SIGMAALDRICH—

Related reactions

4 records
New reaction record
HRID 128031 reaction equation
HRID 128031As productuspto-grants-1981_03
HRID 128032 reaction equation
HRID 128032As reactantuspto-grants-1981_03
HRID 128035 reaction equation
HRID 128035As reactantuspto-grants-1981_03
HRID 1134436 reaction equation
HRID 1134436As productTraining data from https://doi.org/10.1039/C8SC04228D (7/10)

Compound notes

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