1,8-Bis(bromomethyl)naphthalene
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Basic information
- CAS
2025-95-8- Standard SMILES
BrCc1cccc2cccc(CBr)c12- InChIKey
GCZOMCDXYFMAGP-UHFFFAOYSA-N- Molecular formula
- C12H10Br2
- Average molar mass
- 314.01 g/mol
- Monoisotopic mass
- 311.91493
Names & identifiers
- Preferred name
- 1,8-Bis(bromomethyl)naphthalene
- IUPAC
- 1,8-bis(bromomethyl)naphthalene
- English name
- 1,8-Bis(bromomethyl)naphthalene
- Molecular formula
- C12H10Br2
- Molecular weight
- 314.02
Names & synonyms
1,8-Bis(bromomethyl)naphthalene2025-95-8Naphthalene, 1,8-bis(bromomethyl)-GCZOMCDXYFMAGP-UHFFFAOYSA-DTXSID90303037RefChem:73725DTXCID30254170623-194-4GCZOMCDXYFMAGP-UHFFFAOYSA-NInChI=1/C12H10Br2/c13-7-10-5-1-3-9-4-2-6-11(8-14)12(9)10/h1-6H,7-8H2NSC156164SCHEMBL28190
Show more names
1,8-BIS(BROMOMETHYL)NAPHTALENE1,8-Bis(bromomethyl)naphthalene 98%
1,8-di(bromomethyl)naphthalene1,8-bis-bromomethyl-naphthaleneNaphthalene,8-bis(bromomethyl)-MFCD00010251AKOS01591352518-Bis(bromomethyl)naphthaleneSCHEMBL30598018NSC-156164
Database identifiers
- CAS
2025-95-8- PubChem CID
- 291208
- DTXSID
DTXSID90303037- EC Number
- 623-194-4
- Nikkaji
- J150.050C
Properties
Computed structural propertiesFilling in
- XLogP
- 4.3
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 163
Physicochemical properties
- Melting point
- 131 · 131-133 °C (lit.)
- Boiling point
- 386.3 · 386.3±22.0 °C(Predicted)
- Density
- 1.72 · 1.720±0.06 g/cm3(Predicted)
- form
- crystals
- InChI
- 1S/C12H10Br2/c13-7-10-5-1-3-9-4-2-6-11(8-14)12(9)10/h1-6H,7-8H2
- InChIKey
- GCZOMCDXYFMAGP-UHFFFAOYSA-N
- SMILES
- BrCc1cccc2cccc(CBr)c12
- UNSPSC Code
- 12352100 · 12352100
- 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
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
Danger
H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；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
Hazard Classes and CategoriesSkin Corr. 1B (100%)；Eye Dam. 1 (100%)
Safety data
- PPE
- Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges
- wgk
- 3
- ridadr
- UN 3261 8/PG 2
- risk_code
- 34
- Signal word
- Danger
- Symbol(GHS)
- GHS05
- hazard_code
- C
- safety_code
- 26-27-28-36/37/39-45
- hazard_class
- 8
- Storage Class
- 8A - Combustible corrosive hazardous materials
Chemistry & industry
Applications
Uses1,8-Bis(bromomethyl)naphthalene has been used in the synthesis of indan-based unusual α-amino acid derivatives under solid-liquid phase-transfer catalysis conditions.
General DescriptionTwo-photon chemistry of 1,8-bis(bromomethyl)naphthalene has been studied by time-delayed, two-color photolysis and argon ion laser-jet photolysis techniques.
Upstream & downstream products
Downstream products
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Related reactions
5 records
Compound notes
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