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A-Methylstyrene

CAT: 0286-M28000-01Size: 1K gDry Ice: NoHazardous: Yes
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CAT#:0286-M28000-01Size:1K g
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CAS Number
98-83-9
Synonyms
Isopropenylbenzene; 2-Phenyl-1-propene
UN Code
UN2303
Pictogram
02 - Flammable; 07 - Irritant; 09 - Environmental hazard
UDF Signal Word
Warning
MDL Number
MFCD00008859
Hazard Statement
H226 Flammable liquid and vapor; 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; H411 Toxic to aquatic life with long-lasting effects.
DOT Name
Isopropenylbenzene
DOT Classification
Class 3
Packaging Group
PGIII
Precautions
P210 Keep away from heat/sparks/open flames/hot surfaces. — No smoking; P261 Avoid breathing dust/fume/gas/mist/vapors/spray; P273 Avoid release to the environment; 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; P403+P235 Store in a well-ventilated place. Keep cool.

Chemical Information

Alpha-Methylstyrene

α-Methyl styrene (alpha-Methylstyrene) can cause cancer and female reproductive toxicity according to California Labor Code.

CAS Number98-83-9
PubChem CID7407
IUPAC Nameprop-1-en-2-ylbenzene
Molecular FormulaC9H10
Molecular Weight118.18
XLogP3.5
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count1
Heavy Atom Count9
Formal Charge0
Complexity96
SMILES
CC(=C)C1=CC=CC=C1
InChI
InChI=1S/C9H10/c1-8(2)9-6-4-3-5-7-9/h3-7H,1H2,2H3
InChIKey
XYLMUPLGERFSHI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Alpha-Methylstyrene
CAS: 98-83-9
CID: 7407
Formula: C9H10
MW: 118.18
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight118.18
XLogP33.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count1
Exact Mass118.078250319
Monoisotopic Mass118.078250319
Topological Polar Surface Area0 Ų
Heavy Atom Count9
Formal Charge0
Complexity96.6
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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