Cyclopentanecarboxylic acid, 3-(phenylaminocarbonyl)-1,2,2-trimethyl-

Base Information

• Chemical Name: Cyclopentanecarboxylic acid, 3-(phenylaminocarbonyl)-1,2,2-trimethyl-
• CAS No.: 73889-61-9
• Molecular Formula: C16H21NO3
• Molecular Weight: 275.34
• NSC Number: 102701,59796
• DSSTox Substance ID: DTXSID20984838
• Nikkaji Number: J77.928H
• ChEMBL ID: CHEMBL1450471
• Mol file: 73889-61-9.mol

Synonyms:73889-61-9;6629-01-2;NSC 102701;Cyclopentanecarboxylic acid, 3-(phenylaminocarbonyl)-1,2,2-trimethyl-;1,2,2-Trimethyl-3-(anilinocarbonyl)cyclopentanecarboxylic acid;1,2,2-trimethyl-3-(phenylcarbamoyl)cyclopentane-1-carboxylic acid;3-(anilinocarbonyl)-1,2,2-trimethylcyclopentanecarboxylic acid;Cyclopentanecarboxylic acid, 1,2,2-trimethyl-3-((phenylamino)carbonyl)- (VAN);.alpha.-D-Camphoranilic acid;1,2,2-trimethyl-3-(phenylcarbamoyl)cyclopentanecarboxylic acid;NCIOpen2_007289;Oprea1_795643;MLS000058809;CHEMBL1450471;SCHEMBL13544624;DTXSID20984838;HMS2397B03;NSC59796;NSC-59796;NSC102701;STK524158;AKOS000274128;AKOS016040322;NSC-102701;LS-57904;SMR000069075;AB00074725-01;Z234853368;1,2-Trimethyl-3-(anilinocarbonyl)cyclopentanecarboxylic acid;3-(Phenylaminocarbonyl)-1,2,2-trimethyl-1-cyclopentanecarboxylic acid;Cyclopentanecarboxylic acid,2,2-trimethyl-3-[(phenylamino)carbonyl]- (VA;3-[Hydroxy(phenylimino)methyl]-1,2,2-trimethylcyclopentane-1-carboxylic acid

Chemical Property of Cyclopentanecarboxylic acid, 3-(phenylaminocarbonyl)-1,2,2-trimethyl-

Chemical Property:

• Vapor Pressure: 6.29E-10mmHg at 25°C
• Melting Point: 209 - 210 °C
• Boiling Point: 477.5°C at 760 mmHg
• PKA: 4.79±0.60(Predicted)
• Flash Point: 242.6°C
• PSA: 66.40000
• Density: 1.164g/cm³
• LogP: 3.22520
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 275.15214353
• Heavy Atom Count: 20
• Complexity: 399

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1(C(CCC1(C)C(=O)O)C(=O)NC2=CC=CC=C2)C

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