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70289-38-2,MFCD00018998
Catalog No.:AA006A41

70289-38-2 | 4-Chloro-1-(4-isopropylphenyl)butan-1-one

This product is typically in stock,please click "Inquire" below or
contact us at [email protected] for pricing and availability information.
  • Technical Information
  • Properties
  • Literature
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  • Download SDS
Technical Information
Catalog Number:
AA006A41
Chemical Name:
4-Chloro-1-(4-isopropylphenyl)butan-1-one
CAS Number:
70289-38-2
Molecular Formula:
C13H17ClO
Molecular Weight:
224.7265
MDL Number:
MFCD00018998
SMILES:
ClCCCC(=O)c1ccc(cc1)C(C)C
NSC Number:
163136
Properties
Computed Properties
 
Complexity:
193  
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:
5  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3.9  

Literature
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SDS
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Tags:70289-38-2 Molecular Formula|70289-38-2 MDL|70289-38-2 SMILES|70289-38-2 4-Chloro-1-(4-isopropylphenyl)butan-1-one
Catalog No.: AA006A41
70289-38-2,MFCD00018998
70289-38-2 | 4-Chloro-1-(4-isopropylphenyl)butan-1-one
This product is typically in stock,please click "Inquire" below or contact us at [email protected]for pricing and availability information.
Inquire
Technical Information
Catalog Number: AA006A41
Chemical Name: 4-Chloro-1-(4-isopropylphenyl)butan-1-one
CAS Number: 70289-38-2
Molecular Formula: C13H17ClO
Molecular Weight: 224.7265
MDL Number: MFCD00018998
SMILES: ClCCCC(=O)c1ccc(cc1)C(C)C
NSC Number: 163136
Properties
Complexity: 193  
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: 5  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3.9  
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