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4-Bromo-2-fluorobenzaldehyde

Catalog Number
ACM57848461
CAS Number
57848-46-1
Product Name
4-Bromo-2-fluorobenzaldehyde
Structure
Category
Liquid Crystal (LC) Building Blocks
Synonyms
Benzaldehyde, 4-bromo-2-fluoro-
IUPAC Name
4-bromo-2-fluorobenzaldehyde
Molecular Weight
203.01
Molecular Formula
C7H4BrFO
Canonical SMILES
C1=CC(=C(C=C1Br)F)C=O
InChI
InChI=1S/C7H4BrFO/c8-6-2-1-5(4-10)7(9)3-6/h1-4H
InChI Key
UPCARQPLANFGQJ-UHFFFAOYSA-N
Boiling Point
42°C19mm
Melting Point
58-62 ºC (lit.)
Flash Point
42°C/19mm
Purity
98%+
Density
1.67 g/ml
Appearance
White to Orange to Green powder to crystal
Storage
Store under inert gas
Complexity
129
Covalently-Bonded Unit Count
1
Exact Mass
201.94296g/mol
Formal Charge
0
Hazard Statements
H315 : Causes skin irritation.H319 : Causes serious eye irritation.
Heavy Atom Count
10
MDL Number
MFCD00143261
Monoisotopic Mass
201.94296g/mol
Precautionary Statements
P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.
Rotatable Bond Count
1
Safety Description
37/39-26-36
Signal Word
Warning
Supplemental Hazard Statements
H315-H319-H335
XLogP3
2.2
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