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100-80-1,MFCD00008617
Catalog No.:AA000057
Benzene, 1-ethenyl-3-methyl- | 100-80-1
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1g
1 week  
$138.00
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5g
1 week  
$285.00
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10g
1 week  
$479.00
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  • Technical Information
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA000057
Chemical Name:
Benzene, 1-ethenyl-3-methyl-
CAS Number:
100-80-1
Molecular Formula:
C9H10
Molecular Weight:
118.1757
MDL Number:
MFCD00008617
IUPAC Name:
1-ethenyl-3-methylbenzene
InChI:
InChI=1S/C9H10/c1-3-9-6-4-5-8(2)7-9/h3-7H,1H2,2H3
InChI Key:
JZHGRUMIRATHIU-UHFFFAOYSA-N
SMILES:
C=Cc1cccc(c1)C
EC Number:
202-889-2
UNII:
FFK4I9430G
UN Number:
2618
Properties
Computed Properties
 
Complexity:
94.2  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
118.078g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
118.179g/mol
Monoisotopic Mass:
118.078g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  

Synonyms
 
1-ethenyl-3-methylbenzene 
3-ethenylmethylbenzene 
Styrene, m-methyl- 
M-METHYLSTYRENE 
m-Methyl styrene 
meta-Methylstyrene 
UNII-FFK4I9430G 
EINECS 202-889-2 
FFK4I9430G 
JZHGRUMIRATHIU-UHFFFAOYSA-N 
MFCD00008617 
3-Methylstyrene, 95% 
3-vinyltoluene 
DSSTox_CID_1436 
Benzene,1-Ethenyl-3-Methyl- 
m-vinyl toluene 
m-methyl-styrene 
3-Ethenylmethylbenzene 
AC1L1OYV 
AC1Q2NGC 
ACMC-1C4MT 
1-methyl-3-vinyl-benzene 
1-Methyl-3-ethenylbenzene 
3-Methylstyrene 
AC1Q2A6T 
1-ethenyl-3-methyl-benzene 
DSSTox_RID_78088 
DSSTox_GSID_26292 
DSSTox_GSID_51454 
CHEMBL1381662 
DTXSID9051454 
CTK3J6010 
JZHGRUMIRATHIU-UHFFFAOYSA- 
KS-00000YOP 
3-Vinyltoluene 
ZINC2041160 
Tox21_200186 
Tox21_303890 
9514AF 
ANW-41364 
BBL103758 
STL557568 
AKOS009156836 
3-Methylstyrene (stabilized with TBC) 
Benzene, 1-ethenyl-3(or 4)-methyl- 
1-Methyl-3-vinylbenzene 
NCGC00091079-01 
NCGC00091079-02 
NCGC00257740-01 
NCGC00357147-01 
AJ-33284 
AN-18751 
AS-47795 
CAS-100-80-1 
CJ-32523 
CAS-25013-15-4 
100-80-1 
LS-147223 
RT-002816 
ST2403465 
4CH-018725 
FT-0616183 
M0260 
J-000224 
I14-50054 
I14-52012 
UNII-521V79L8MY component JZHGRUMIRATHIU-UHFFFAOYSA-N 
m-Vinyltoluene 
InChI=1/C9H10/c1-3-9-6-4-5-8(2)7-9/h3-7H,1H2,2H3 
3-Methylstyrene, 99%, contains 0.1% 3,5-di-tert-butylcatechol as inhibitor 
Vinyl toluene 
Methylstyrene 
3-methylstyren 
VINYLTOLUENE 
Benzene, ethenylmethyl- 
Benceno, 1-etenil-3-metil- 
CID7529 
C9H10 
1-Ethenyl-3-methylbenzene 
AR-1C4523 
C9-H10 
3-Methylstyrene, 95% - 5ML 5ml 
ACN-042434 
Vinyl toluene (65-71% m- and 32-35% p-) 
25013-15-4 
3-Methylstyrene, 98%, stabilized with TBC - 5ML 5ml 
39294-88-7 
41153-83-7 
Benzene, 1-ethenyl-3-methyl- 
Literature

Title: Metal-stabilized thiyl radicals as scaffolds for reversible alkene addition via C-S bond formation/cleavage.

Journal: Inorganic chemistry 20111017

Title: Internal rotation of methyl group in electronically excited o- and m-ethynyltoluene: new correlation between the Hammett substituent constant σm and rotational barrier change.

Journal: The Journal of chemical physics 20110227

Title: Preparation, physical properties, on-bead binding assay and spectroscopic reliability of 25 barcoded polystyrene-poly(ethylene glycol) graft copolymers.

Journal: Journal of the American Chemical Society 20030903

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