Anthracenecarboxaldehyde

HCID 35864
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Basic information

CAS
31671-77-9
Standard SMILES
O=Cc1cccc2cc3ccccc3cc12
InChIKey
XJDFBLQCLSBCGQ-UHFFFAOYSA-N
Molecular formula
C15H10O
Average molar mass
206.24 g/mol
Monoisotopic mass
206.07316494

Names & identifiers

Preferred name
Anthracenecarboxaldehyde
IUPAC
anthracene-1-carbaldehyde

Names & synonyms

ANTHRACENECARBOXALDEHYDE31671-77-9DTXSID60185564RefChem:319768DTXCID00108055anthracene-1-carbaldehyde1140-79-01-Anthracenecarboxaldehyde1-Anthracenecarbaldehydeanthralanthraldehyde1-Anthraldehyde
Show more names
SCHEMBL39718SCHEMBL194326SCHEMBL5745526SCHEMBL5747007SCHEMBL5748185SCHEMBL5748315SCHEMBL5749430SCHEMBL5749446

Database identifiers

CAS
31671-77-9
PubChem CID
35864
DTXSID
DTXSID60185564
Nikkaji
J80.197F

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
17.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
1
Heavy atoms
16

Related reactions

16 records
New reaction record

Compound notes

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