Homovanillyl Alcohol

CAS
2380-78-1
Catalog Number
ACM2380781
Category
Alcohols
Molecular Weight
168.19
Molecular Formula
C9H12O3

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Specification

IUPAC Name
4-(2-hydroxyethyl)-2-methoxyphenol
Canonical SMILES
COC1=C(C=CC(=C1)CCO)O
InChI
InChI=1S/C9H12O3/c1-12-9-6-7(4-5-10)2-3-8(9)11/h2-3,6,10-11H,4-5H2,1H3
InChI Key
XHUBSJRBOQIZNI-UHFFFAOYSA-N
Appearance
Oil
Hazard Statements
H315-H319-H335
RIDADR
UN 1987C 3 / PGIII
Symbol
GHS07
What is the PubChem CID for homovanillyl alcohol?

The PubChem CID for homovanillyl alcohol is 16928.

What is the molecular formula of homovanillyl alcohol?

The molecular formula of homovanillyl alcohol is C9H12O3.

What are some synonyms for homovanillyl alcohol?

Some synonyms for homovanillyl alcohol include 4-Hydroxy-3-methoxyphenethanol, 4-(2-Hydroxyethyl)-2-methoxyphenol, and 3-METHOXY-4-HYDROXYPHENYLETHANOL.

Where can homovanillyl alcohol be found in nature?

Homovanillyl alcohol is a natural product found in Saussurea medusa, Urtica dioica, and other organisms.

Is homovanillyl alcohol a metabolite found in Saccharomyces cerevisiae?

Yes, homovanillyl alcohol is a metabolite found in Saccharomyces cerevisiae.

What is the IUPAC name of homovanillyl alcohol?

The IUPAC name of homovanillyl alcohol is 4-(2-hydroxyethyl)-2-methoxyphenol.

What is the InChIKey of homovanillyl alcohol?

The InChIKey of homovanillyl alcohol is XHUBSJRBOQIZNI-UHFFFAOYSA-N.

What is the canonical SMILES representation of homovanillyl alcohol?

The canonical SMILES representation of homovanillyl alcohol is COC1=C(C=CC(=C1)CCO)O.

What is the CAS number of homovanillyl alcohol?

The CAS number of homovanillyl alcohol is 2380-78-1.

What is the molecular weight of homovanillyl alcohol?

The molecular weight of homovanillyl alcohol is 168.19 g/mol.

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