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Benzylphenylcarbamyl chloride

HCID 352202
NotesReactions

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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
108749-74-2
Standard SMILES
O=C(Cl)N(Cc1ccccc1)c1ccccc1
InChIKey
KVNPRHJSNCFLEG-UHFFFAOYSA-N
Molecular formula
C14H12ClNO
Average molar mass
245.7 g/mol
Monoisotopic mass
245.0607417

Names & identifiers

Preferred name
Benzylphenylcarbamyl chloride
IUPAC
N-benzyl-N-phenylcarbamoyl chloride

Names & synonyms

benzylphenylcarbamyl chloride108749-74-2DTXSID10326208RefChem:328865DTXCID10277322benzyl(phenyl)carbamic chlorideCarbamic chloride, phenyl(phenylmethyl)-NSC525330benzylphenylcarbamoyl chlorideSCHEMBL2814910Benzyl(phenyl)carbamoyl chlorideKVNPRHJSNCFLEG-UHFFFAOYSA-N
Show more names
NSC-525330

Database identifiers

CAS
108749-74-2
PubChem CID
352202
DTXSID
DTXSID10326208

Properties

Computed structural propertiesFilling in

XLogP
3.8
Topological polar surface area
20.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
3
Heavy atoms
17
Formal charge
0
Complexity
245

Related reactions

4 records
New reaction record
HRID 193084 reaction equation
HRID 193084As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 502801 reaction equation
HRID 502801As reactantuspto-grants-2010_08
HRID 2114612 reaction equation
HRID 2114612As reactantuspto-grants-2008_10
HRID 2160983 reaction equation
HRID 2160983As reactantTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes