Basic information
- CAS
1940-57-4- Standard SMILES
BrC1c2ccccc2-c2ccccc21- InChIKey
AHCDKANCCBEQJJ-UHFFFAOYSA-N- Molecular formula
- C13H9Br
- Average molar mass
- 245.11 g/mol
- Monoisotopic mass
- 243.98876
Names & identifiers
- Preferred name
- 9-Bromofluorene
- IUPAC
- 9-bromo-9H-fluorene
- English name
- 9-Bromofluorene
- Molecular formula
- C13H9Br
- Molecular weight
- 245.11
Names & synonyms
Show more names
Database identifiers
- CAS
1940-57-4- PubChem CID
- 16024
- DTXSID
DTXSID40173020- UNII
- Z497X72T8Q
- EC Number
- 217-722-9
- Nikkaji
- J49.644H
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 191
Physicochemical properties
- Melting point
- 101 · 101-104 °C(lit.)
- Boiling point
- 288.79 °C · 288.79°C (rough estimate)
- Density
- 1.4187 · 1.4187 (rough estimate)
- refractive index
- 1.629 · 1.6290 (estimate)
- storage temp.
- Inert atmosphere,Room Temperature
- form
- powder to crystal
- color
- White to Light yellow
- Water Solubility
- Insoluble in water.
- Sensitive
- Air Sensitive
- BRN
- 2047220 · 2047220
- InChI
- 1S/C13H9Br/c14-13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)13/h1-8,13H
- InChIKey
- AHCDKANCCBEQJJ-UHFFFAOYSA-N
- SMILES
- BrC1c2ccccc2-c3ccccc13
- CAS DataBase Reference
- 1940 · 1940-57-4(CAS DataBase Reference)
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 497 X72T8Q · Z497X72T8Q
- NIST Chemistry Reference
- 9 H-fluorene, · 9H-fluorene, 9-bromo-(1940-57-4)
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 5 · GHS05
- Signal word
- Danger
- Hazard statements
- 314 · H314
- Precautionary statements
- 260 · P260-P280-P303+P361+P353-P304+P340+P310-P305+P351+P338-P363
- PPE
- 3 · Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges
- Hazard Codes
- C
- Risk Statements
- 34 · 34-43
- Safety Statements
- 26 · 26-36/37/39-45
- RIDADR
- 1759 · UN 1759 8/PG 2
- WGK Germany
- 3 · 3
- RTECS
- 5890000 · LL5890000
- HS Code
- 2903.99 · 2903.99.8001
- HazardClass
- 8 · 8
- PackingGroup
- III
- Storage Class
- 8 A · 8A - Combustible corrosive hazardous materials
- Hazard Classifications
- 1 B · Skin Corr. 1B
- Toxicity
- 50 · mouse,LD50,intravenous,180mg/kg (180mg/kg),U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#01610,
- Limited Quantities
- 1 Kg · 1 Kg (2.2 lbs) (solid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (500g or 500ml)
Safety & regulation
GHS classification
GHS Classification
Danger
H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 45 reports by companies from 3 notifications to the ECHA C&L Inventory.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard information
Safety data
- PPE
- Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges
- wgk
- 3
- rtecs
- LL5890000
- ridadr
- UN 1759 8/PG 2
- hs_code
- 2903.99.8001
- Toxicity
- mouse,LD50,intravenous,180mg/kg (180mg/kg),U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#01610,
- risk_code
- 34-43
- Signal word
- Danger
- Symbol(GHS)
- GHS05
- hazard_code
- C
- safety_code
- 26-36/37/39-45
- hazard_class
- 8
- Storage Class
- 8A - Combustible corrosive hazardous materials
- packing_group
- III
- Hazard statements
- H314
- Limited Quantities
- 1 Kg (2.2 lbs) (solid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (500g or 500ml)
- Hazard Classifications
- Skin Corr. 1B
- Precautionary statements
- P260-P280-P303+P361+P353-P304+P340+P310-P305+P351+P338-P363
Chemistry & industry
Applications
Uses9-Bromofluorene, is used to treat skin dermatological conditions and in pharmaceutical industry.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers100 total
Related reactions
Compound notes
Loading…