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5162-03-8,MFCD00000558
Catalog No.:AA00324K

5162-03-8 | 2-Chlorobenzophenone

Pack Size
Purity
Availability
Price(USD)
Quantity
  
10g
98%
in stock  
$7.00   $5.00
- +
25g
98%
in stock  
$11.00   $8.00
- +
100g
98%
in stock  
$17.00   $12.00
- +
500g
98%
in stock  
$54.00   $38.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00324K
Chemical Name:
2-Chlorobenzophenone
CAS Number:
5162-03-8
Molecular Formula:
C13H9ClO
Molecular Weight:
216.6630
MDL Number:
MFCD00000558
SMILES:
Clc1ccccc1C(=O)c1ccccc1
NSC Number:
62529
Properties
Properties
 
BP:
330.6°C at 760 mmHg  
Form:
Solid  
MP:
44-47 °C(lit.)  
Refractive Index:
1.5260 (estimate)  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
221  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
4  

Upstream Synthesis Route

[1]JournalofFluorineChemistry,1990,vol.50,#3,p.411-426

[2]JournalofFluorineChemistry,1990,vol.50,#3,p.411-426

Downstream Synthesis Route

[1]SyntheticCommunications,2003,vol.33,p.229-236

[2]OrganicLetters,2000,vol.2,p.659-661

[3]Patent:EP1437344,2004,A1.Locationinpatent:Page45-46

[4]Tetrahedron,2007,vol.63,p.429-434

[5]RecueildesTravauxChimiquesdesPays-Bas,1912,vol.31,p.311

[6]RecueildesTravauxChimiquesdesPays-Bas,1915,vol.34,p.162

[7]RecueildesTravauxChimiquesdesPays-Bas,1919,vol.38,p.121

[8]JournaloftheAmericanChemicalSociety,1956,vol.78,p.4081

[9]JournalofOrganicChemistry,1948,vol.13,p.916,920

[10]JustusLiebigsAnnalenderChemie,1969,vol.726,p.1-12

[11]TetrahedronAsymmetry,1991,vol.2,p.339-342

[12]JournalofOrganicChemistry,1991,vol.56,p.2573-2575

[13]TetrahedronLetters,1995,vol.36,p.3797-3800

[14]BioorganicandMedicinalChemistryLetters,1996,vol.6,p.311-314

[15]JournalofMedicinalChemistry,1997,vol.40,p.851-857

[16]OrganicandBiomolecularChemistry,2006,vol.4,p.1561-1571

[17]Chemistry-AEuropeanJournal,2008,vol.14,p.10388-10395

[18]Lettersindrugdesignanddiscovery,2010,vol.7,p.661-664

[19]ArchivderPharmazie,2011,vol.344,p.402-410

[20]Organometallics,2013,vol.32,p.5581-5588

[21]RSCAdvances,2014,vol.4,p.27955-27962

[1]ChineseChemicalLetters,2015,vol.26,p.1236-1240

[2]BioorganicandMedicinalChemistry,2000,vol.8,p.1139-1149

[3]RecueildesTravauxChimiquesdesPays-Bas,1910,vol.29,p.143

[4]Tetrahedron,2007,vol.63,p.2695-2711

[5]JournalofChemistry,2015,vol.2015

[6]ChemistryLetters,2017,vol.46,p.1512-1514

[1]BulletindelaSocieteChimiquedeFrance,1969,p.2747-2753

[1]CanadianJournalofChemistry,1988,vol.66,p.1617-1624

[1]JournalofFluorineChemistry,1990,vol.50,p.411-426

[2]JournalofFluorineChemistry,1990,vol.50,p.411-426

Literature

Title: Inclusion complex of 2-chlorobenzophenone with cyclomaltoheptaose (β-cyclodextrin): temperature, solvent effects and molecular modeling.

Journal: Carbohydrate research 20110927

Title: N'-Benzoyl-N-tert-butyl-2-chloro-N'-{[3-(6-chloro-3-pyrid-ylmethyl)-2-nitrimino-imidazolidin-1-yl]sulfan-yl}benzo-hydrazide.

Journal: Acta crystallographica. Section E, Structure reports online 20090901

Title: 2-Amino-5-nitro-phenyl 2-chloro-phenyl ketone.

Journal: Acta crystallographica. Section E, Structure reports online 20090801

Title: Experimental and computational studies on the molecular energetics of chlorobenzophenones.

Journal: The journal of physical chemistry. B 20071115

Quotation Request
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SDS
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Tags:5162-03-8 Molecular Formula|5162-03-8 MDL|5162-03-8 SMILES|5162-03-8 2-Chlorobenzophenone
Catalog No.: AA00324K
5162-03-8,MFCD00000558
5162-03-8 | 2-Chlorobenzophenone
Pack Size： 10g
Purity： 98%
in stock
$7.00 $5.00
Pack Size： 25g
Purity： 98%
in stock
$11.00 $8.00
Pack Size： 100g
Purity： 98%
in stock
$17.00 $12.00
Pack Size： 500g
Purity： 98%
in stock
$54.00 $38.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00324K
Chemical Name: 2-Chlorobenzophenone
CAS Number: 5162-03-8
Molecular Formula: C13H9ClO
Molecular Weight: 216.6630
MDL Number: MFCD00000558
SMILES: Clc1ccccc1C(=O)c1ccccc1
NSC Number: 62529
Properties
BP: 330.6°C at 760 mmHg  
Form: Solid  
MP: 44-47 °C(lit.)  
Refractive Index: 1.5260 (estimate)  
Storage: Keep in dry area;Room Temperature;  
Complexity: 221  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 15  
Hydrogen Bond Acceptor Count: 1  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 4  
Upstream Synthesis Route
75-61-6    5162-03-8    727-99-1    133391-53-4 

[1]JournalofFluorineChemistry,1990,vol.50,#3,p.411-426

[2]JournalofFluorineChemistry,1990,vol.50,#3,p.411-426

Downstream Synthesis Route
5162-03-8    6954-45-6 

[1]SyntheticCommunications,2003,vol.33,p.229-236

[2]OrganicLetters,2000,vol.2,p.659-661

[3]Patent:EP1437344,2004,A1.Locationinpatent:Page45-46

[4]Tetrahedron,2007,vol.63,p.429-434

[5]RecueildesTravauxChimiquesdesPays-Bas,1912,vol.31,p.311

[6]RecueildesTravauxChimiquesdesPays-Bas,1915,vol.34,p.162

[7]RecueildesTravauxChimiquesdesPays-Bas,1919,vol.38,p.121

[8]JournaloftheAmericanChemicalSociety,1956,vol.78,p.4081

[9]JournalofOrganicChemistry,1948,vol.13,p.916,920

[10]JustusLiebigsAnnalenderChemie,1969,vol.726,p.1-12

[11]TetrahedronAsymmetry,1991,vol.2,p.339-342

[12]JournalofOrganicChemistry,1991,vol.56,p.2573-2575

[13]TetrahedronLetters,1995,vol.36,p.3797-3800

[14]BioorganicandMedicinalChemistryLetters,1996,vol.6,p.311-314

[15]JournalofMedicinalChemistry,1997,vol.40,p.851-857

[16]OrganicandBiomolecularChemistry,2006,vol.4,p.1561-1571

[17]Chemistry-AEuropeanJournal,2008,vol.14,p.10388-10395

[18]Lettersindrugdesignanddiscovery,2010,vol.7,p.661-664

[19]ArchivderPharmazie,2011,vol.344,p.402-410

[20]Organometallics,2013,vol.32,p.5581-5588

[21]RSCAdvances,2014,vol.4,p.27955-27962

5162-03-8    71225-69-9 

[1]ChineseChemicalLetters,2015,vol.26,p.1236-1240

[2]BioorganicandMedicinalChemistry,2000,vol.8,p.1139-1149

[3]RecueildesTravauxChimiquesdesPays-Bas,1910,vol.29,p.143

[4]Tetrahedron,2007,vol.63,p.2695-2711

[5]JournalofChemistry,2015,vol.2015

[6]ChemistryLetters,2017,vol.46,p.1512-1514

917-64-6    5162-03-8    24892-81-7 

[1]BulletindelaSocieteChimiquedeFrance,1969,p.2747-2753

288-16-4    5162-03-8    118173-48-1 

[1]CanadianJournalofChemistry,1988,vol.66,p.1617-1624

75-61-6    5162-03-8    727-99-1    133391-53-4 

[1]JournalofFluorineChemistry,1990,vol.50,p.411-426

[2]JournalofFluorineChemistry,1990,vol.50,p.411-426

Literature fold

Title: Inclusion complex of 2-chlorobenzophenone with cyclomaltoheptaose (β-cyclodextrin): temperature, solvent effects and molecular modeling.

Journal: Carbohydrate research20110927

Title: N'-Benzoyl-N-tert-butyl-2-chloro-N'-{[3-(6-chloro-3-pyrid-ylmethyl)-2-nitrimino-imidazolidin-1-yl]sulfan-yl}benzo-hydrazide.

Journal: Acta crystallographica. Section E, Structure reports online20090901

Title: 2-Amino-5-nitro-phenyl 2-chloro-phenyl ketone.

Journal: Acta crystallographica. Section E, Structure reports online20090801

Title: Experimental and computational studies on the molecular energetics of chlorobenzophenones.

Journal: The journal of physical chemistry. B20071115

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