9H-Fluorene-9,9-dimethanol - ≥98% , CAS No.4425-93-8

CAS: 4425-93-8 Cat. No.: I136618 Peso molecular: 226.27 Número EC: 610-170-3

GRADE & PURITY ≥98%

Synonyms

SB37204 | A851672 | DTXSID50322885 | (9-Hydroxymethyl-9H-fluoren-9-yl)-methanol | C75196 | DS-15155 | NSC 402230 | 9,9-bis(hydroxymethyl)fluorene | 9,9-bis(hydroxymethyl)-fluorene | AMY18620 | MFCD01321348 | 9,9-di(hydroxymethyl)fluorene | Fluorene-9,9-di

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

SB37204 | A851672 | DTXSID50322885 | (9-Hydroxymethyl-9H-fluoren-9-yl)-methanol | C75196 | DS-15155 | NSC 402230 | 9, 9-bis(hydroxymethyl)fluorene | 9, 9-bis(hydroxymethyl)-fluorene | AMY18620 | MFCD01321348 | 9, 9-di(hydroxymethyl)fluorene | Fluorene-9, 9-di

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 488189560
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488189560
• Sonrisas canónicas: C1=CC=C2C(=C1)C3=CC=CC=C3C2(CO)CO
• IUPAC Name: [9-(hydroxymethyl)fluoren-9-yl]methanol
• InChIKey: RHBLISBUFROBBC-UHFFFAOYSA-N
• INCHI: 1S/C15H14O2/c16-9-15(10-17)13-7-3-1-5-11(13)12-6-2-4-8-14(12)15/h1-8,16-17H,9-10H2
• Isómeros SMILES: C1=CC=C2C(=C1)C3=CC=CC=C3C2(CO)CO
• WGK Alemania: 3
• Peso molecular: 226.27
• Reaxy-Rn: 2113401
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2113401&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Fluorenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Fluorenes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Fluorenes
• Alternative Parents: Primary alcohols Hydrocarbon derivatives
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Fluorene - Organic oxygen compound - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Alcohol - Aromatic homopolycyclic compound
• Descripción: 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

Propiedades químicas y físicas

• Peso molecular: 226.270 g/mol
• XLogP3: 2.000
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 226.099 Da
• Monoisotopic Mass: 226.099 Da
• Topological Polar Surface Area: 40.500 Ų
• Heavy Atom Count: 17
• Formal Charge: 0
• Complexity: 248.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Referencias

1. Song Liu, Henggang Wang, Dongbo Chen, Chenglong Ji, Zhenguang Wang.  (2025)  Efficient and long-lived room temperature phosphorescence materials via melt-injection reactions.  DYES AND PIGMENTS,      [PMID:] [10.1016/j.dyepig.2025.113270]