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Reference substances

Currently viewing:
IUPAC name:
Benzene, ethenylethyl-

Inventory

EC number:
248-846-1
EC name:
Ethylstyrene
CAS number:
28106-30-1
CAS number:
28106-30-1
Synonyms
Names:
Benzene, ethenylethyl-
ethylvinylbenzen
Identifier:
IUPAC name
1-ethenyl-2-ethylbenzene
Identifier:
IUPAC name
1-ethyl-2-vinylbenzene
Identifier:
IUPAC name
Ethylstyrene
Identifier:
IUPAC name
Ethylvinylbenzene
Identifier:
other: InChl
1-ethenyl-2-ethyl-benzene: InChI=1S/C10H12/c1-3-9-7-5-6-8-10(9)4-2/h3,5-8H,1,4H2,2H31-ethenyl-3-ethyl-benzene: InChI=1S/C10H12/c1-3-9-6-5-7-10(4-2)8-9/h3,5-8H,1,4H2,2H31-ethenyl-4-ethyl-benzene : InChI=1S/C10H12/c1-3-9-5-7-10(4-2)8-6-9/h3,5-8H,1,4H2,2H3
Identifier:
other: SMILES notation
1-ethenyl-2-ethyl-benzene: C=Cc1ccccc1CC1-ethenyl-3-ethyl-benzene: C=Cc1cccc(CC)c11-ethenyl-4-ethyl-benzene: C=Cc1ccc(CC)cc1
Identifier:
other: InChl
1-ethenyl-2-ethyl-benzene: InChI=1S/C10H12/c1-3-9-7-5-6-8-10(9)4-2/h3,5-8H,1,4H2,2H3 1-ethenyl-3-ethyl-benzene: InChI=1S/C10H12/c1-3-9-6-5-7-10(4-2)8-9/h3,5-8H,1,4H2,2H3 1-ethenyl-4-ethyl-benzene : InChI=1S/C10H12/c1-3-9-5-7-10(4-2)8-6-9/h3,5-8H,1,4H2,2H3
Identifier:
other: SMILES notation
C=Cc1ccccc1CC C=Cc1cccc(CC)c1 C=Cc1ccc(CC)cc1
Identifier:
other: SMILES notation
C=Cc1ccccc1CC . C=Cc1cccc(CC)c1 . C=Cc1ccc(CC)cc1
Identifier:
other: SMILES notation
CCc1ccccc1C=C
Identifier:
other: SMILES notation
CCc1ccccc1C=C.C=Cc1ccc(CC)cc1.C=Cc1cccc(CC)c1
Identifier:
other: InChl
InChI=1/C10H12/c1-3-9-7-5-6-8-10(9)4-2/h3,5-8H,1,4H2,2H3
Identifier:
other: InChl
InChI=1S/3C10H12/c1-3-9-5-7-10(4-2)8-6-9;1-3-9-6-5-7-10(4-2)8-9;1-3-9-7-5-6-8-10(9)4-2/h3*3,5-8H,1,4H2,2H3
Identifier:
other: InChl
InChI=1S/C10H12/c1-3-9-7-5-6-8-10(9)4-2/h3,5-8H,1,4H2,2H3 InChI=1S/C10H12/c1-3-9-6-5-7-10(4-2)8-9/h3,5-8H,1,4H2,2H3 InChI=1S/C10H12/c1-3-9-5-7-10(4-2)8-6-9/h3,5-8H,1,4H2,2H3

Molecular and structural information

Molecular formula:
C10H12
Molecular weight:
ca. 132.202
SMILES notation:
1-ethenyl-2-ethyl-benzene: C=Cc1ccccc1CC
1-ethenyl-3-ethyl-benzene: C=Cc1cccc(CC)c1
1-ethenyl-4-ethyl-benzene: C=Cc1ccc(CC)cc1
InChl:
1-ethenyl-2-ethyl-benzene: InChI=1S/C10H12/c1-3-9-7-5-6-8-10(9)4-2/h3,5-8H,1,4H2,2H3
1-ethenyl-3-ethyl-benzene: InChI=1S/C10H12/c1-3-9-6-5-7-10(4-2)8-9/h3,5-8H,1,4H2,2H3
1-ethenyl-4-ethyl-benzene : InChI=1S/C10H12/c1-3-9-5-7-10(4-2)8-6-9/h3,5-8H,1,4H2,2H3

Structural formula:
Chemical structure

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