4-ethyl-3-(9H-fluoren-9-ylmethoxycarbonylamino)hexanoic acid - ≥97% , CAS No.1067538-11-7

CAS: 1067538-11-7 Cat. No.: E626741 Molecular Weight: 381.46 PubChem CID: 71050184

GRADE & PURITY ≥97%

Synonyms

1067538-11-7 | 4-ethyl-3-(9H-fluoren-9-ylmethoxycarbonylamino)hexanoic acid | SCHEMBL14024234 | F88962 | EN300-1286893 | 4-ethyl-3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)hexanoic acid

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

1067538-11-7 | 4-ethyl-3-(9H-fluoren-9-ylmethoxycarbonylamino)hexanoic acid | SCHEMBL14024234 | F88962 | EN300-1286893 | 4-ethyl-3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)hexanoic acid

Specifications & Purity

≥97%

Storage

Room temperature

Shipped In

Normal

Purity

≥97%

Names and Identifiers

• Canonical Smiles: CCC(CC)C(CC(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13
• IUPAC Name: 4-ethyl-3-(9H-fluoren-9-ylmethoxycarbonylamino)hexanoic acid
• InChIKey: BEGJXWWAYQYVLQ-UHFFFAOYSA-N
• INCHI: 1S/C23H27NO4/c1-3-15(4-2)21(13-22(25)26)24-23(27)28-14-20-18-11-7-5-9-16(18)17-10-6-8-12-19(17)20/h5-12,15,20-21H,3-4,13-14H2,1-2H3,(H,24,27)(H,25,26)
• Isomeric SMILES: CCC(CC)C(CC(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13
• PubChem CID: 71050184
• Molecular Weight: 381.46

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Class Fluorenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Fluorenes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Fluorenes
• Alternative Parents: Medium-chain fatty acids Branched fatty acids Amino fatty acids Carbamate esters Monocarboxylic acids and derivatives Carboxylic acids Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Fluorene - Medium-chain fatty acid - Amino fatty acid - Branched fatty acid - Fatty acyl - Fatty acid - Carbamic acid ester - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Aromatic homopolycyclic compound
• Description: This compound belongs to the class of organic compounds known as fluorenes. These are compounds containing a fluorene moiety, which consists of two benzene rings connected through either a cyclopentane, cyclopentene, or cyclopenta-1,3-diene.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y