HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.9
  1. Home
  2. /Compound

7-Hydroxy-3-(4-methoxyphenyl)-1-naphthonitrile

HCID 11254366
New noteNew reactionRequest quotesPrint preview
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
COc1ccc(-c2cc(C#N)c3cc(O)ccc3c2)cc1
InChIKey
ZNQNTFMRLVTHQY-UHFFFAOYSA-N
Molecular formula
C18H13NO2
Average molar mass
275.3 g/mol

Names & identifiers

Preferred name
7-Hydroxy-3-(4-methoxyphenyl)-1-naphthonitrile
IUPAC
7-hydroxy-3-(4-methoxyphenyl)naphthalene-1-carbonitrile

Names & synonyms

SCHEMBL5980999ZNQNTFMRLVTHQY-UHFFFAOYSA-N7-Hydroxy-3-(4-methoxyphenyl)-1-naphthonitrile

Database identifiers

PubChem CID
11254366

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
53.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
21
Formal charge
0
Complexity
393

Suppliers

Loading…

Open inquiries

Loading…

Related reactions

9 records
New reaction record
HRID 170864 reaction equation
HRID 170864As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 686764 reaction equation
HRID 686764As reactantTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 895232 reaction equation
HRID 895232As productuspto-grants-2005_07
HRID 895236 reaction equation
HRID 895236As reactantuspto-grants-2005_07
HRID 895245 reaction equation
HRID 895245As reactantuspto-grants-2005_07
HRID 1830677 reaction equation
HRID 1830677As productuspto-grants-2006_06
HRID 1830681 reaction equation
HRID 1830681As reactantuspto-grants-2006_06
HRID 1830690 reaction equation
HRID 1830690As reactantuspto-grants-2006_06
Page 1 of 2

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes