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P-Tolyl Ethyl Ketone

CAT: 0286-T16245Size: 10 gDry Ice: NoHazardous: No
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CAT#:0286-T16245Size:10 g
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CAS Number
5337-93-9
Pictogram
07 - Irritant
UDF Signal Word
Warning
MDL Number
MFCD00009312
Hazard Statement
H302 Harmful if swallowed; H312 Harmful in contact with skin; H315 Causes skin irritation; H320 Causes 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

p-Methylpropiophenone

4-methylpropiophenone is an aromatic ketone that is propiophenone bearing a methyl group at C-4. It is functionally related to a propiophenone.

CAS Number5337-93-9
PubChem CID21429
IUPAC Name1-(4-methylphenyl)propan-1-one
Molecular FormulaC10H12O
Molecular Weight148.20
XLogP2.6
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Heavy Atom Count11
Formal Charge0
Complexity132
SMILES
CCC(=O)C1=CC=C(C=C1)C
InChI
InChI=1S/C10H12O/c1-3-10(11)9-6-4-8(2)5-7-9/h4-7H,3H2,1-2H3
InChIKey
PATYHUUYADUHQS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of p-Methylpropiophenone
CAS: 5337-93-9
CID: 21429
Formula: C10H12O
MW: 148.20
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight148.20
XLogP32.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass148.088815002
Monoisotopic Mass148.088815002
Topological Polar Surface Area17.1 Ų
Heavy Atom Count11
Formal Charge0
Complexity132
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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Alternative Products

CatalogName
LC-6539.1Ethyl methyl ketone p.A.
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OR1080929-013- (1- (p-tolyl) ethyl) aniline
OR1078691-01Ethyl (E) -3- (p-Tolyl) acrylate
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