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3,4-Dihydrocyclopenta[cd]pyren-4-ol

HCID 115331
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Basic information

CAS
80010-98-6
Standard SMILES
OC1Cc2ccc3ccc4cccc5cc1c2c3c45
InChIKey
MTPQVBORAVXWFJ-UHFFFAOYSA-N
Molecular formula
C18H12O
Average molar mass
244.293 g/mol
Monoisotopic mass
244.088815

Names & identifiers

Preferred name
3,4-Dihydrocyclopenta[cd]pyren-4-ol
IUPAC
3,4-Dihydrocyclopenta[cd]pyren-4-ol
English name
4-hydroxy-3,4-dihydrocyclopenta(cd)pyrene
Molecular weight
0

Names & synonyms

4-hydroxy-3,4-dihydrocyclopenta(cd)pyrene

Database identifiers

CAS
80010-98-6
PubChem CID
115331
DTXSID
DTXSID701000903
Nikkaji
J487.841H

Chemistry & industry

Applications · 1 item

Uses3,4-Dihydrocyclopenta[cd]pyren-4-ol is a metabolite of a environmental pollutant and suspected human carcinogen cyclopenta[cd]pyrene (CPP).Also, it is an intermediate used in the synthesis of Acepyrene (A130950), which is a novel constituent discovered that belongs to the pyrene class of the polycyclic aromatic hydrocarbons. Acepyrene occurs in a large variety of carbon black soots, in cigarette smoke and is a major representative of PAH in car engine exhaust gases.

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