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1-(4-Chlorophenyl)cyclopropane-1-carbonyl chloride

HCID 22016175
NotesReactions
Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
78682-33-4
Standard SMILES
O=C(Cl)C1(c2ccc(Cl)cc2)CC1
InChIKey
SJONAMDHFQGIQE-UHFFFAOYSA-N
Molecular formula
C10H8Cl2O
Average molar mass
215.07 g/mol
Monoisotopic mass
213.99522024

Names & identifiers

Preferred name
1-(4-Chlorophenyl)cyclopropane-1-carbonyl chloride
IUPAC
1-(4-chlorophenyl)cyclopropane-1-carbonyl chloride
English name
Cyclopropanecarbonyl chloride, 1-(4-chlorophenyl)- (9CI)
Molecular formula
C10H8Cl2O
Molecular weight
215.08

Names & synonyms

78682-33-41-(4-chlorophenyl)cyclopropanecarbonyl chloride1-(4-Chlorophenyl)cyclopropane-1-carbonyl chlorideCyclopropanecarbonylchloride, 1-(4-chlorophenyl)-SCHEMBL3554737CYCLOPROPANECARBONYL CHLORIDE,1-(4-CHLOROPHENYL)-DTXSID60621533SJONAMDHFQGIQE-UHFFFAOYSA-NDB-3539931-(4-chloro-phenyl)-cyclopropanecarbonyl chlorideCyclopropanecarbonyl chloride, 1-(4-chlorophenyl)- (9CI)

Database identifiers

CAS
78682-33-4
PubChem CID
22016175
DTXSID
DTXSID60621533

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
17.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
2
Heavy atoms
13
Formal charge
0
Complexity
215

Chemistry & industry

Suppliers3 total

CHEMSTEP[email protected]
Aldlab Chemicals, LLC[email protected]
MATRIX[email protected]

Related reactions

3 records
New reaction record
HRID 1174662 reaction equation
HRID 1174662As productuspto-grants-2010_11
HRID 1174663 reaction equation
HRID 1174663As reactantuspto-grants-2010_11
HRID 2140868 reaction equation
HRID 2140868As productTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

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