CAS 24324-17-2 9H-Fluorene-9-methanol (HCID 90466)

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Basic information

CAS: 24324-17-2
Standard SMILES: OCC1c2ccccc2-c2ccccc21
InChIKey: XXSCONYSQQLHTH-UHFFFAOYSA-N
Molecular formula: C14H12O
Average molar mass: 196.24 g/mol
Monoisotopic mass: 196.088815

Names & identifiers

Preferred name: 9H-Fluorene-9-methanol
IUPAC: 9H-fluoren-9-ylmethanol
English name: 9-Fluorenemethanol
Molecular formula: C14H12O
Molecular weight: 196.24

Names & synonyms

24324-17-29H-Fluorene-9-methanolFluorene-9-methanol(Fluoren-9-yl)methanolEINECS 246-167-5DTXSID7066980RefChem:549969DTXCID1037064246-167-59-Fluorenemethanol9-Fluorenylmethanol9H-Fluoren-9-ylmethanol

Show more names

FMOC-OHFMOLFM-OHFoMc-OHFluorenemethanolFLUORENYL METHANOLHOFMFMOC-hydroxy

(9h-fluoren-9-yl)methanol9-(Hydroxymethyl)fluorene9-HydroxymethylfluoreneMFCD000011399-Fluorenyl Methanolfluoren-9-ylmethan-1-ol9-fluorenmethanol9-FluorenYl-Methanol

Database identifiers

CAS: 24324-17-2
PubChem CID: 90466
DTXSID: DTXSID7066980
UNII: AWJ7E4RKJ8
EC Number: 246-167-5
Nikkaji: J208.517H

Properties

Computed structural properties

XLogP: 2.7
Topological polar surface area: 20.2 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 1
Heavy atoms: 15
Formal charge: 0
Complexity: 203

Experimental & physicochemical properties

LogP2.89

Endocrine DisruptorsPotential endocrine disrupting compound

Physicochemical properties

Melting point: 105 · 105-107 °C (lit.)
Boiling point: 293.14 °C · 293.14°C (rough estimate)
Density: 1.0304 · 1.0304 (rough estimate)
refractive index: 1.5385 · 1.5385 (estimate)
storage temp.: Sealed in dry,Room Temperature
solubility: Soluble in methanol.
form: Crystalline Powder
pka: 13.68 · 13.68±0.10(Predicted)
color: White to pale yellow
BRN: 2330017 · 2330017
InChI: InChI=1S/C14H12O/c15-9-14-12-7-3-1-5-10(12)11-6-2-4-8-13(11)14/h1-8,14-15H,9H2

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

PPE: Eyeshields, Gloves, type N95 (US)
wgk: 3
tsca: TSCA listed
hs_code: 29062900
risk_code: 36/37/38
Signal word: Warning
Symbol(GHS): GHS07
hazard_code: Xi
hazard_note: Irritant
safety_code: 22-24/25-36/37/39-27-26
Storage Class: 11 - Combustible Solids
Hazard statements: H302-H320-H402
Precautionary statements: P501-P273-P270-P264-P337+P313-P305+P351+P338-P301+P312+P330

Chemistry & industry

Uses & manufacturing

General Manufacturing Information9H-Fluorene-9-methanol: INACTIVE

Applications · 3 items

Uses9-Fluorenylmethanol(FMOC-OH) acts as a N-protecting reagent, which is used in the synthesis of peptide. It is also used in the preparation of deoxynucleoside 9-fluorenemethyl phosphorodithioates. Further, it is used to prepare 9-(fluoromethyl)fluorene. In addition to this, it is involved in the electropolymerization with boron trifluoride diethyl etherate to yield low-potential electrodeposition of semiconducting poly(9-fluorenemethanol) film.

Uses9-Fluorenemethanol(FMOC-OH), N-protecting reagent, was used in the peptide syntheses. 9-Fluorenemethanol was also used in the synthesis of deoxynucleoside 9-fluorenemethyl phosphorodithioates.

General DescriptionVibrational spectroscopy of jet-cooled 9-fluorenemethanol and its clusters 9-fluorenemethanol-H2O, 9-fluorenemethanol-CH3OH, 9-fluorenemethanol-C2H5OH and 9-fluorenemethanol-C3H7OH has been studied by IR-UV double-resonance method.

Preparation methods · 1 item

PreparationIn the presence of a catalyst, a hydrogen atom at the 9-position of fluorene is removed as a proton, and the resulting fluorene anion reacts with ethyl formate to produce 9-fluorenaldehyde. Using a reducing agent, 9-fluorenaldehyde is reduced to the crude product 9-Fluorenemethanol.