1246819-30-6,MFCD30145894
Catalog No.:AA009FJ0

1246819-30-6 | Isohexanol-d7

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  • Properties
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Technical Information
Catalog Number:
AA009FJ0
Chemical Name:
Isohexanol-d7
CAS Number:
1246819-30-6
Molecular Formula:
C6H7D7O
Molecular Weight:
109.2179
MDL Number:
MFCD30145894
SMILES:
OCCCC(C([2H])([2H])[2H])(C([2H])([2H])[2H])[2H]
Properties
Computed Properties
 
Complexity:
33.2  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
7  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.6  

Literature
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Additional Info:
SDS
Tags:1246819-30-6 Molecular Formula|1246819-30-6 MDL|1246819-30-6 SMILES|1246819-30-6 Isohexanol-d7
Catalog No.: AA009FJ0
1246819-30-6,MFCD30145894
1246819-30-6 | Isohexanol-d7
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: AA009FJ0
Chemical Name: Isohexanol-d7
CAS Number: 1246819-30-6
Molecular Formula: C6H7D7O
Molecular Weight: 109.2179
MDL Number: MFCD30145894
SMILES: OCCCC(C([2H])([2H])[2H])(C([2H])([2H])[2H])[2H]
Properties
Complexity: 33.2  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 7  
Hydrogen Bond Acceptor Count: 1  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 7  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.6  
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