HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

2-methoxy-9H-xanthene

HCID 9859174
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
COc1ccc2c(c1)Cc1ccccc1O2
InChIKey
QZTUHJIPLHLSPP-UHFFFAOYSA-N
Molecular formula
C14H12O2
Average molar mass
212.24 g/mol

Names & identifiers

Preferred name
2-methoxy-9H-xanthene
IUPAC
2-methoxy-9H-xanthene

Names & synonyms

2-methoxy-9H-xanthene2-methoxy-xanthenemethyl 9H-xanthen-2-yl etherSCHEMBL1127596SCHEMBL5244835SCHEMBL5244840SCHEMBL5757673QZTUHJIPLHLSPP-UHFFFAOYSA-N38731-89-4

Database identifiers

PubChem CID
9859174
Nikkaji
J2.930.125E

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
18.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
16
Formal charge
0
Complexity
241

Related reactions

1 records
New reaction record
HRID 1275524 reaction equation
HRID 1275524As reactantuspto-grants-2000_12

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes