1-Methylfluorene
Basic information
- CAS
1730-37-6- Standard SMILES
Cc1cccc2c1Cc1ccccc1-2- InChIKey
GKEUODMJRFDLJY-UHFFFAOYSA-N- Molecular formula
- C14H12
- Average molar mass
- 180.24 g/mol
- Monoisotopic mass
- 180.09390038
Overview
1-Methylfluorene is a member of fluorenes.
Names & identifiers
- Preferred name
- 1-Methylfluorene
- IUPAC
- 1-methyl-9H-fluorene
- English name
- 1-Methylfluorene
- Molecular formula
- C14H12
- Molecular weight
- 180.25
Names & synonyms
1-Methylfluorene1-Methyl-9H-fluorene1730-37-6Fluorene, 1-methyl-9H-Fluorene, 1-methyl-DTXSID4061919NSC-801835DR03K3111RefChem:76389DTXCID7035519217-048-5Methylfluorene
Show more names
MFCD00001131UNII-5DR03K31111-Methyl-fluoreneEINECS 217-048-5NSC 801831-methyl-9H-fluoren1-methyl-9H-luorene1-Methylfluorene, 98%
Database identifiers
- CAS
1730-37-6- PubChem CID
- 15604
- DTXSID
DTXSID4061919- ChEMBL
CHEMBL1797283- ChEBI
CHEBI:180972- UNII
- 5DR03K3111
- EC Number
- 217-048-5
- Nikkaji
- J102.693C
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 208
Experimental & physicochemical properties
PolymersOther Classes -> Polycyclic Aromatic Hydrocarbons
LogP4.97
Vapor Pressure0.000398 [mmHg]
Physical DescriptionSolid; [Aldrich MSDS]
Physicochemical properties
- Melting point
- 85 °C · 85 °C
- Boiling point
- 318.1 °C · 318.1 °C
- Density
- 1.095 · 1.095±0.06 g/cm3(Predicted)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 75% (3 of 4) of all reports.
Warning
H302 (25%): 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)
Aggregated GHS information provided per 4 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazards SummaryMay cause irritation; [Aldrich MSDS] See Fluorene. See POLYCYCLIC AROMATIC HYDROCARBONS.
Hazard Classes and CategoriesAcute Tox. 4 (25%)
Suppliers
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Related reactions
6 records
Compound notes
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