CAS
94134-36-8 Purity
96%
94134-36-8 Purity
96%
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1-[Bis-(2-phenylethoxy)methyl]-4-methoxybenzene
CAS
94134-42-6
Catalog Number
ACM94134426
Category
Other Products
Molecular Weight
362.461440 [g/mol]
Molecular Formula
C24H26O3
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Specification
Synonyms
EINECS 302-810-2, CID3023675, 1-(Bis(2-phenylethoxy)methyl)-4-methoxybenzene, 94134-42-6
IUPAC Name
1-(diphenethyloxymethyl)-4-methoxybenzene
Canonical SMILES
COC1=CC=C(C=C1)C(OCCC2=CC=CC=C2)OCCC3=CC=CC=C3
InChI Key
MCHNHTONQUYDHQ-UHFFFAOYSA-N
Boiling Point
468.9ºC at 760mmHg
Flash Point
160.6ºC
Density
1.096g/cm³
EC Number
302-810-2
Exact Mass
362.18800
H-Bond Acceptor
3
H-Bond Donor
0
What is the molecular formula of the compound associated with PubChem CID 3023675?
The molecular formula is C24H26O3.
When was the compound created in PubChem?
The compound was created on August 8, 2005.
What is the molecular weight of the compound?
The molecular weight is 362.5 g/mol.
What is the IUPAC name of the compound?
The IUPAC name is 1-[bis(2-phenylethoxy)methyl]-4-methoxybenzene.
What is the InChIKey of the compound?
The InChIKey is MCHNHTONQUYDHQ-UHFFFAOYSA-N.
How many hydrogen bond acceptors does the compound have?
The compound has 3 hydrogen bond acceptors.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value is 5.4.
How many rotatable bonds does the compound have?
The compound has 10 rotatable bonds.
Is the compound canonicalized?
Yes, the compound is canonicalized.
What is the topological polar surface area of the compound?
The topological polar surface area is 27.7 Ų.
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