1254475-87-0,MFCD18382139
Catalog No.:AA01DPFK

1254475-87-0 | JWH-018 N-Pentyl-5-carboxylic Acid

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  • Technical Information
  • Properties
  • Literature
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Technical Information
Catalog Number:
AA01DPFK
Chemical Name:
JWH-018 N-Pentyl-5-carboxylic Acid
CAS Number:
1254475-87-0
Molecular Formula:
C24H21NO3
Molecular Weight:
371.4284
MDL Number:
MFCD18382139
SMILES:
OC(=O)CCCCn1cc(c2c1cccc2)C(=O)c1cccc2c1cccc2
Properties
Computed Properties
 
Complexity:
562  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
7  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
4.7  

Literature

Title: Cytochrome P450-mediated oxidative metabolism of abused synthetic cannabinoids found in K2/Spice: identification of novel cannabinoid receptor ligands.

Journal: Drug metabolism and disposition: the biological fate of chemicals 20121101

Title: Quantitative measurement of JWH-018 and JWH-073 metabolites excreted in human urine.

Journal: Analytical chemistry 20110601

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SDS
Tags:1254475-87-0 Molecular Formula|1254475-87-0 MDL|1254475-87-0 SMILES|1254475-87-0 JWH-018 N-Pentyl-5-carboxylic Acid
Catalog No.: AA01DPFK
1254475-87-0,MFCD18382139
1254475-87-0 | JWH-018 N-Pentyl-5-carboxylic Acid
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: AA01DPFK
Chemical Name: JWH-018 N-Pentyl-5-carboxylic Acid
CAS Number: 1254475-87-0
Molecular Formula: C24H21NO3
Molecular Weight: 371.4284
MDL Number: MFCD18382139
SMILES: OC(=O)CCCCn1cc(c2c1cccc2)C(=O)c1cccc2c1cccc2
Properties
Complexity: 562  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 28  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 7  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 4.7  
Literature fold

Title: Cytochrome P450-mediated oxidative metabolism of abused synthetic cannabinoids found in K2/Spice: identification of novel cannabinoid receptor ligands.

Journal: Drug metabolism and disposition: the biological fate of chemicals20121101

Title: Quantitative measurement of JWH-018 and JWH-073 metabolites excreted in human urine.

Journal: Analytical chemistry20110601

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