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167144-80-1,MFCD06407939
Catalog No.:AA01E2KW

167144-80-1 | R-96544Hydrochloride

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:
AA01E2KW
Chemical Name:
R-96544Hydrochloride
CAS Number:
167144-80-1
Molecular Formula:
C22H30ClNO3
Molecular Weight:
391.9315
MDL Number:
MFCD06407939
SMILES:
COc1cccc(c1)CCc1ccccc1OCC[C@@H]1C[C@H](CN1C)O.Cl
Properties
Computed Properties
 
Complexity:
405  
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0  
Rotatable Bond Count:
8  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  

Literature
Quotation Request
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SDS
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Tags:167144-80-1 Molecular Formula|167144-80-1 MDL|167144-80-1 SMILES|167144-80-1 R-96544Hydrochloride
Catalog No.: AA01E2KW
167144-80-1,MFCD06407939
167144-80-1 | R-96544Hydrochloride
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: AA01E2KW
Chemical Name: R-96544Hydrochloride
CAS Number: 167144-80-1
Molecular Formula: C22H30ClNO3
Molecular Weight: 391.9315
MDL Number: MFCD06407939
SMILES: COc1cccc(c1)CCc1ccccc1OCC[C@@H]1C[C@H](CN1C)O.Cl
Properties
Complexity: 405  
Covalently-Bonded Unit Count: 2  
Defined Atom Stereocenter Count: 2  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 27  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 2  
Isotope Atom Count: 0  
Rotatable Bond Count: 8  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
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