9-Phenyl-9-fluorenol
PubChem CID
141227
Structure
Molecular Formula
Synonyms
- 9-Phenyl-9-fluorenol
- 25603-67-2
- 9-Phenyl-9H-fluoren-9-ol
- 9-phenylfluoren-9-ol
- 9-Hydroxy-9-phenylfluorene
Molecular Weight
258.3 g/mol
Computed by PubChem 2.2 (PubChem release 2021.10.14)
Dates
- Create:2005-03-26
- Modify:2024-12-28
Chemical Structure Depiction
9-phenylfluoren-9-ol
Computed by Lexichem TK 2.7.0 (PubChem release 2021.10.14)
InChI=1S/C19H14O/c20-19(14-8-2-1-3-9-14)17-12-6-4-10-15(17)16-11-5-7-13-18(16)19/h1-13,20H
Computed by InChI 1.0.6 (PubChem release 2021.10.14)
UJPHBDAPVWFPTG-UHFFFAOYSA-N
Computed by InChI 1.0.6 (PubChem release 2021.10.14)
C1=CC=C(C=C1)C2(C3=CC=CC=C3C4=CC=CC=C42)O
Computed by OEChem 2.3.0 (PubChem release 2021.10.14)
C19H14O
Computed by PubChem 2.2 (PubChem release 2021.10.14)
25603-67-2
- 9-Phenyl-9-fluorenol
- 25603-67-2
- 9-Phenyl-9H-fluoren-9-ol
- 9-phenylfluoren-9-ol
- 9-Hydroxy-9-phenylfluorene
- 9H-Fluoren-9-ol, 9-phenyl-
- MFCD00037121
- NSC 25984
- DTXSID30180283
- NSC25984
- Cambridge id 5122043
- SCHEMBL813078
- 9-Phenyl-9-fluorenol, 99%
- 9-Phenyl-9H-fluoren-9-ol #
- CHEMBL4541933
- DTXCID40102774
- CS-B0320
- NSC-25984
- STK701339
- AKOS005521988
- AC-5820
- SB66476
- DS-17419
- SY038307
- P1231
- BRD-K35218659-001-01-4
- 9-Phenyl-9H-fluoren-9-ol; 9-Phenylfluoren-9-ol; 9-Phenylfluorenol; 9-Hydroxy-9-phenylfluorene; NSC 25984
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
258.3 g/mol
Reference
Computed by PubChem 2.2 (PubChem release 2021.10.14)
Property Name
XLogP3-AA
Property Value
3.9
Reference
Computed by XLogP3 3.0 (PubChem release 2021.10.14)
Property Name
Hydrogen Bond Donor Count
Property Value
1
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Property Name
Hydrogen Bond Acceptor Count
Property Value
1
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Property Name
Rotatable Bond Count
Property Value
1
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Property Name
Exact Mass
Property Value
258.104465066 Da
Reference
Computed by PubChem 2.2 (PubChem release 2021.10.14)
Property Name
Monoisotopic Mass
Property Value
258.104465066 Da
Reference
Computed by PubChem 2.2 (PubChem release 2021.10.14)
Property Name
Topological Polar Surface Area
Property Value
20.2Ų
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Property Name
Heavy Atom Count
Property Value
20
Reference
Computed by PubChem
Property Name
Formal Charge
Property Value
0
Reference
Computed by PubChem
Property Name
Complexity
Property Value
322
Reference
Computed by Cactvs 3.4.8.18 (PubChem release 2021.10.14)
Property Name
Isotope Atom Count
Property Value
0
Reference
Computed by PubChem
Property Name
Defined Atom Stereocenter Count
Property Value
0
Reference
Computed by PubChem
Property Name
Undefined Atom Stereocenter Count
Property Value
0
Reference
Computed by PubChem
Property Name
Defined Bond Stereocenter Count
Property Value
0
Reference
Computed by PubChem
Property Name
Undefined Bond Stereocenter Count
Property Value
0
Reference
Computed by PubChem
Property Name
Covalently-Bonded Unit Count
Property Value
1
Reference
Computed by PubChem
Property Name
Compound Is Canonicalized
Property Value
Yes
Reference
Computed by PubChem (release 2021.10.14)
NIST Number
135391
Library
Main library
Total Peaks
128
m/z Top Peak
181
m/z 2nd Highest
258
m/z 3rd Highest
152
Thumbnail
NIST Number
301687
Library
Replicate library
Total Peaks
89
m/z Top Peak
258
m/z 2nd Highest
181
m/z 3rd Highest
152
Thumbnail
Follow these links to do a live 2D search or do a live 3D search for this compound, sorted by annotation score. This section is deprecated (see here for details), but these live search links provide equivalent functionality to the table that was previously shown here.
Same Parent, Exact Count
Mixtures, Components, and Neutralized Forms Count
Similar Compounds (2D)
Similar Conformers (3D)
PubMed Count
Patents are available for this chemical structure:
https://patentscope.wipo.int/search/en/result.jsf?inchikey=UJPHBDAPVWFPTG-UHFFFAOYSA-N
- ChEMBLLICENSEAccess to the web interface of ChEMBL is made under the EBI's Terms of Use (http://www.ebi.ac.uk/Information/termsofuse.html). The ChEMBL data is made available on a Creative Commons Attribution-Share Alike 3.0 Unported License (http://creativecommons.org/licenses/by-sa/3.0/).http://www.ebi.ac.uk/Information/termsofuse.html
- ChemIDplus9-Phenyl-9-fluorenolhttps://pubchem.ncbi.nlm.nih.gov/substance/?source=chemidplus&sourceid=0025603672ChemIDplus Chemical Information Classificationhttps://pubchem.ncbi.nlm.nih.gov/source/ChemIDplus
- DTP/NCILICENSEUnless otherwise indicated, all text within NCI products is free of copyright and may be reused without our permission. Credit the National Cancer Institute as the source.https://www.cancer.gov/policies/copyright-reuse
- EPA DSSTox9-Phenyl-9-fluorenolhttps://comptox.epa.gov/dashboard/DTXSID30180283
- Crystallography Open Database (COD)LICENSEAll data in the COD and the database itself are dedicated to the public domain and licensed under the CC0 License. Users of the data should acknowledge the original authors of the structural data.https://creativecommons.org/publicdomain/zero/1.0/
- Japan Chemical Substance Dictionary (Nikkaji)
- NIST Mass Spectrometry Data CenterLICENSEData covered by the Standard Reference Data Act of 1968 as amended.https://www.nist.gov/srd/public-law9-Phenyl-9-fluorenolhttp://www.nist.gov/srd/nist1a.cfm
- SpectraBase9-Phenyl-9H-fluoren-9-olhttps://spectrabase.com/spectrum/2ABpPCIs3U9-Phenyl-9H-fluoren-9-olhttps://spectrabase.com/spectrum/5iwy53JjoYU9-HYDROXY-9-PHENYL-FLUORENEhttps://spectrabase.com/spectrum/2HNalMzhXo09-Phenyl-9-fluorenolhttps://spectrabase.com/spectrum/BHZKSzK8uE69-Phenyl-9-fluorenolhttps://spectrabase.com/spectrum/3weACKOF2L99-Phenyl-9-fluorenolhttps://spectrabase.com/spectrum/48MQT1D0Uit
- Springer Nature
- Thieme ChemistryLICENSEThe Thieme Chemistry contribution within PubChem is provided under a CC-BY-NC-ND 4.0 license, unless otherwise stated.https://creativecommons.org/licenses/by-nc-nd/4.0/
- Wikidata9-Phenyl-9-fluorenolhttps://www.wikidata.org/wiki/Q72501870
- PubChem
- MolGenieMolGenie Organic Chemistry Ontologyhttps://github.com/MolGenie/ontology/
- PATENTSCOPE (WIPO)SID 389360951https://pubchem.ncbi.nlm.nih.gov/substance/389360951
CONTENTS