Structure

3-Phenoxybenzyl alcohol

CAS
13826-35-2
Catalog Number
ACM13826352
Category
Alkynyl
Molecular Weight
200.23
Molecular Formula
C13H12O2

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Specification

Synonyms
(3-Phenoxyphenyl)methanol
Complexity
175
Defined Atom Stereocenter Count
0
Exact Mass
200.0837
Formal Charge
0
Hazard Statements
H315-H319-H335
Heavy Atom Count
15
Hydrogen Bond Acceptor Count
2
Hydrogen Bond Donor Count
1
Isotope Atom Count
0
Monoisotopic Mass
200.0837
RIDADR
NONH for all modes of transport
Rotatable Bond Count
3
Symbol
GHS07
Topological Polar Surface Area
29.5 Ų
XLogP3-AA
2.5
What is the molecular formula of 3-Phenoxybenzyl alcohol?

The molecular formula of 3-Phenoxybenzyl alcohol is C13H12O2.

What is the molecular weight of 3-Phenoxybenzyl alcohol?

The molecular weight of 3-Phenoxybenzyl alcohol is 200.23 g/mol.

What is the IUPAC name of 3-Phenoxybenzyl alcohol?

The IUPAC name of 3-Phenoxybenzyl alcohol is (3-phenoxyphenyl)methanol.

What is the InChI of 3-Phenoxybenzyl alcohol?

The InChI of 3-Phenoxybenzyl alcohol is InChI=1S/C13H12O2/c14-10-11-5-4-8-13(9-11)15-12-6-2-1-3-7-12/h1-9,14H,10H2.

What is the InChIKey of 3-Phenoxybenzyl alcohol?

The InChIKey of 3-Phenoxybenzyl alcohol is KGANAERDZBAECK-UHFFFAOYSA-N.

What is the canonical SMILES of 3-Phenoxybenzyl alcohol?

The canonical SMILES of 3-Phenoxybenzyl alcohol is C1=CC=C(C=C1)OC2=CC=CC(=C2)CO.

What is the CAS number of 3-Phenoxybenzyl alcohol?

The CAS number of 3-Phenoxybenzyl alcohol is 13826-35-2.

What is the XLogP3 value of 3-Phenoxybenzyl alcohol?

The XLogP3 value of 3-Phenoxybenzyl alcohol is 2.5.

How many hydrogen bond donor counts does 3-Phenoxybenzyl alcohol have?

3-Phenoxybenzyl alcohol has 1 hydrogen bond donor count.

How many hydrogen bond acceptor counts does 3-Phenoxybenzyl alcohol have?

3-Phenoxybenzyl alcohol has 2 hydrogen bond acceptor counts.

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