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

4-Acenaphthenol

HCID 226745
New noteNew reactionRequest quotesPrint preview
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
6296-98-6
Standard SMILES
Oc1cc2c3c(cccc3c1)CC2
InChIKey
OSSBHMYNGLXRNY-UHFFFAOYSA-N
Molecular formula
C12H10O
Average molar mass
170.21 g/mol
Monoisotopic mass
170.07316494

Names & identifiers

Preferred name
4-Acenaphthenol
IUPAC
1,2-dihydroacenaphthylen-4-ol

Names & synonyms

4-Acenaphthenol6296-98-6DTXSID30280575RefChem:289585DTXCID302317291,2-dihydroacenaphthylen-4-olNSC17484SCHEMBL5376020NSC-17484

Database identifiers

CAS
6296-98-6
PubChem CID
226745
DTXSID
DTXSID30280575
Nikkaji
J610.571H

Properties

Computed structural properties

XLogP
3.6
Topological polar surface area
20.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
0
Heavy atoms
13
Formal charge
0
Complexity
201

Suppliers

Loading…

Open inquiries

Loading…

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes