Structure

4-Iodobenzyloxybenzene

CAS
19578-68-8
Catalog Number
ACM19578688
Category
Ethers
Molecular Weight
310.13
Molecular Formula
C13H10O4

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Specification

Synonyms
4-Benzyloxyiodobenzene, 1-(Benzyloxy)-4-iodobenzene, 19578-68-8, 1-benzyloxy-4-iodobenzene, 4-Iodobenzyloxybenzene, 4-Iodophenoxymethyl resin, 4-Iodophenol, polymer-bound, 1-iodo-4-phenylmethoxybenzene, AG-E-43129, ST51038517, ZINC00403505, ACMC-20amon, AC1LASTZ, 4-Benzyl-Oxyiodobenzene, SureCN74111, AC1Q4P8N, 532185_ALDRICH, 570788_ALDRICH, 4-iodo-1-(phenylmethoxy)benzene, CTK4E1852
IUPAC Name
1-iodo-4-phenylmethoxybenzene
Canonical SMILES
C1=CC=C(C=C1)COC2=CC=C(C=C2)I
InChI Key
MPWFGAWFTAZWKZ-UHFFFAOYSA-N
Boiling Point
140ºC 1mm
Melting Point
60-63ºC
Flash Point
171.6ºC
Density
1.58g/cm³
Exact Mass
309.98500
Hazard Statements
H318
H-Bond Acceptor
1
H-Bond Donor
0
RIDADR
UN 2811 6.1 / PGIII
Safety Description
S22-S24/25
Symbol
GHS05
WGK Germany
3
What is the molecular formula of 4-Iodobenzyloxybenzene?

The molecular formula of 4-Iodobenzyloxybenzene is C13H11IO.

When was 4-Iodobenzyloxybenzene first created?

4-Iodobenzyloxybenzene was first created on March 27, 2005.

What is the molecular weight of 4-Iodobenzyloxybenzene?

The molecular weight of 4-Iodobenzyloxybenzene is 310.13 g/mol.

What are some synonyms for 4-Iodobenzyloxybenzene?

Some synonyms for 4-Iodobenzyloxybenzene include 1-(Benzyloxy)-4-iodobenzene, 4-Benzyloxyiodobenzene, and 1-benzyloxy-4-iodobenzene.

What is the Canonical SMILES representation of 4-Iodobenzyloxybenzene?

The Canonical SMILES representation of 4-Iodobenzyloxybenzene is C1=CC=C(C=C1)COC2=CC=C(C=C2)I.

What is the InChIKey of 4-Iodobenzyloxybenzene?

The InChIKey of 4-Iodobenzyloxybenzene is MPWFGAWFTAZWKZ-UHFFFAOYSA-N.

How many hydrogen bond donor counts does 4-Iodobenzyloxybenzene have?

4-Iodobenzyloxybenzene does not have any hydrogen bond donor counts.

What is the XLogP3 value of 4-Iodobenzyloxybenzene?

The XLogP3 value of 4-Iodobenzyloxybenzene is 4.4.

How many defined atom stereocenter counts does 4-Iodobenzyloxybenzene have?

4-Iodobenzyloxybenzene does not have any defined atom stereocenter counts.

Is 4-Iodobenzyloxybenzene a canonicalized compound?

Yes, 4-Iodobenzyloxybenzene is a canonicalized compound.

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