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Structure

2,3-Dibenzyl-1,3-butadiene

CAS
62640-74-8
Catalog Number
ACM62640748
Category
Other Products; Alkenes
Molecular Weight
234.34
Molecular Formula
[C6H5CH2C(=CH2)-]2

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Specification

Synonyms
2,3-Dibenzyl-1,3-butadiene, 62640-74-8, ACMC-1BAGG, AC1MSFN5, 392413_ALDRICH, CTK5B5433, AKOS015889004, (3-benzyl-2-methylidenebut-3-enyl)benzene, I01-17439
IUPAC Name
(3-benzyl-2-methylidenebut-3-enyl)benzene
Canonical SMILES
C=C(CC1=CC=CC=C1)C(=C)CC2=CC=CC=C2
InChI Key
FNCJMHZWHWRYEO-UHFFFAOYSA-N
Boiling Point
359.3ºC at 760 mmHg
Melting Point
86-88ºC (dec.)(lit.)
Flash Point
184ºC
Density
0.981g/cm³
Exact Mass
234.14100
Hazard Statements
Xn
H-Bond Acceptor
0
H-Bond Donor
0
RIDADR
NONH for all modes of transport
Safety Description
22-26-36
Symbol
GHS09
What is the molecular formula of 2,3-Dibenzyl-1,3-butadiene?

The molecular formula is C18H18.

What is the molecular weight of 2,3-Dibenzyl-1,3-butadiene?

The molecular weight is 234.3 g/mol.

What is the IUPAC name of 2,3-Dibenzyl-1,3-butadiene?

The IUPAC name is (3-benzyl-2-methylidenebut-3-enyl)benzene.

What is the InChI of 2,3-Dibenzyl-1,3-butadiene?

The InChI is InChI=1S/C18H18/c1-15(13-17-9-5-3-6-10-17)16(2)14-18-11-7-4-8-12-18/h3-12H,1-2,13-14H2.

What is the InChIKey of 2,3-Dibenzyl-1,3-butadiene?

The InChIKey is FNCJMHZWHWRYEO-UHFFFAOYSA-N.

What is the canonical SMILES of 2,3-Dibenzyl-1,3-butadiene?

The canonical SMILES is C=C(CC1=CC=CC=C1)C(=C)CC2=CC=CC=C2.

What is the CAS number of 2,3-Dibenzyl-1,3-butadiene?

The CAS number is 62640-74-8.

What is the European Community (EC) number of 2,3-Dibenzyl-1,3-butadiene?

The European Community (EC) number is 622-944-8.

What is the DSSTox Substance ID of 2,3-Dibenzyl-1,3-butadiene?

The DSSTox Substance ID is DTXSID50393398.

Is 2,3-Dibenzyl-1,3-butadiene a canonicalized compound?

Yes, it is a canonicalized compound.

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