3-(dibenzylamino)cyclohexanone - ≥97% , CAS No.30539-21-0

CAS: 30539-21-0 Cat. No.: C638196 분자식: C₂₀H₂₃NO 분자량: 293.4 PubChem CID: 10880905

GRADE & PURITY ≥97%

Synonyms

3-(Dibenzylamino)cyclohexanone | 30539-21-0 | 3-(dibenzylamino)cyclohexan-1-one | SCHEMBL13734229 | PB48896 | E83414

Storage

Room temperature

Shipped In

Normal

Specifications

동의어

3-(Dibenzylamino)cyclohexanone | 30539-21-0 | 3-(dibenzylamino)cyclohexan-1-one | SCHEMBL13734229 | PB48896 | E83414

사양 및 순도

≥97%

보관 조건

Room temperature

배송

Normal

순수함

≥97%

이름과 식별자

• 정식 스마일: C1CC(CC(=O)C1)N(CC2=CC=CC=C2)CC3=CC=CC=C3
• IUPAC Name: 3-(dibenzylamino)cyclohexan-1-one
• InChIKey: RKVXAQBTCYQPKE-UHFFFAOYSA-N
• INCHI: 1S/C20H23NO/c22-20-13-7-12-19(14-20)21(15-17-8-3-1-4-9-17)16-18-10-5-2-6-11-18/h1-6,8-11,19H,7,12-16H2
• 이성체 SMILES: C1CC(CC(=O)C1)N(CC2=CC=CC=C2)CC3=CC=CC=C3
• PubChem CID: 10880905
• 분자량: 293.4

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • 분류 Benzene and substituted derivatives
      • Subclass Phenylmethylamines

• Kingdom: Organic compounds
• Superclass: Benzenoids
• 분류: Benzene and substituted derivatives
• Subclass: Phenylmethylamines
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylmethylamines
• Alternative Parents: Benzylamines Aralkylamines Trialkylamines Cyclic ketones Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Benzylamine - Phenylmethylamine - Aralkylamine - Ketone - Tertiary amine - Tertiary aliphatic amine - Cyclic ketone - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Amine - Organic nitrogen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Aromatic homomonocyclic compound
• 설명: This compound belongs to the class of organic compounds known as phenylmethylamines. These are compounds containing a phenylmethtylamine moiety, which consists of a phenyl group substituted by an methanamine.
• 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