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M-Bromoacetophenone 97%

CAT: 0286-B18340-03Size: 100 gDry Ice: NoHazardous: No
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CAT#:0286-B18340-03Size:100 g
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CAS Number
2142-63-4
Synonyms
3'-Bromoacetophenone; 1-Acetyl-3-bromobenzene; m-Bromophenyl methyl ketone
Pictogram
07 - Irritant
UDF Signal Word
Warning
MDL Number
MFCD00000083
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

3'-Bromoacetophenone
CAS Number2142-63-4
PubChem CID16502
IUPAC Name1-(3-bromophenyl)ethanone
Molecular FormulaC8H7BrO
Molecular Weight199.04
XLogP2.6
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count10
Formal Charge0
Complexity133
SMILES
CC(=O)C1=CC(=CC=C1)Br
InChI
InChI=1S/C8H7BrO/c1-6(10)7-3-2-4-8(9)5-7/h2-5H,1H3
InChIKey
JYAQYXOVOHJRCS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3'-Bromoacetophenone
CAS: 2142-63-4
CID: 16502
Formula: C8H7BrO
MW: 199.04
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight199.04
XLogP32.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass197.96803
Monoisotopic Mass197.96803
Topological Polar Surface Area17.1 Ų
Heavy Atom Count10
Formal Charge0
Complexity133
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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