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5-Bromo-O-Anisaldehyde 99%

CAT: 0286-B18528-01Size: 25 gDry Ice: NoHazardous: No
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CAT#:0286-B18528-01Size:25 g
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CAS Number
25016-01-7
Pictogram
07 - Irritant
UDF Signal Word
Warning
MDL Number
MFCD00003347
Hazard Statement
H302 Harmful if swallowed; H312 Harmful in contact with skin; H315 Causes skin irritation; H319 Causes serious eye irritation; H332 Harmful if inhaled; H335 May cause respiratory irritation.
DOT Name
Not D.O.T.-Regulated
Precautions
P261 Avoid breathing dust/fume/gas/mist/vapors/spray; P280 Wear protective gloves/protective clothing/eye protection/face protection; P301+P312 IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell; P302+P352 IF ON SKIN: wash with plenty of soap and water; P304+P340 IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing; P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing; P332+P313 IF SKIN irritation occurs: Get medical advice/attention.

Chemical Information

5-Bromo-2-methoxybenzaldehyde
CAS Number25016-01-7
PubChem CID90684
IUPAC Name5-bromo-2-methoxybenzaldehyde
Molecular FormulaC8H7BrO2
Molecular Weight215.04
XLogP2
Topological Polar Surface Area26.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count11
Formal Charge0
Complexity138
SMILES
COC1=C(C=C(C=C1)Br)C=O
InChI
InChI=1S/C8H7BrO2/c1-11-8-3-2-7(9)4-6(8)5-10/h2-5H,1H3
InChIKey
IJIBRSFAXRFPPN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-Bromo-2-methoxybenzaldehyde
CAS: 25016-01-7
CID: 90684
Formula: C8H7BrO2
MW: 215.04
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight215.04
XLogP32
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass213.96294
Monoisotopic Mass213.96294
Topological Polar Surface Area26.3 Ų
Heavy Atom Count11
Formal Charge0
Complexity138
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
FA59855-01O-Anisaldehyde
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