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CAS Number: 34246-96-3
1-methoxypyrene

Structure

1-methoxypyrene
Name: 1-methoxypyrene
Synonyms:
General Information
Product Number: 34246963

CAS Registry Number 34246-96-3
Name:
Pyrene, 1-​methoxy-
1-Hydroxypyrene methyl ether
1-Methoxypyrene
3-Methoxypyrene

 

Chemical Formula: C17H12O
Exact Mass: 232.09
Molecular Weight: 232.28
m/z: 232.09 (100.0%), 233.09 (18.4%), 234.10 (1.6%)

 

InChI:InChI=1S/C17H12O/c1-18-15-10-8-13-6-5-11-3-2-4-12-7-9-14(15)17(13)16(11)12/h2-10H,1H3

InChI Key:CPPFVJLHDNOVTN-UHFFFAOYSA-N

Canonical SMILES:COC1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1

 

Thermal Properties Value Condition Note
Melting Point 155 °C   (5)CAS
Melting Point 128-129 °C   (6)CAS
Melting Point 93 °C Solv: ethanol (64-17-5) (7)IC
Melting Point 88 °C   (8)CAS

Specification

98%

References
  1. (5) Jacquignon, Pierre; Bulletin de la Societe Chimique de France 1964, (3), P646-8. CAPLUS
  2. (6) Cook, J. W.; Journal of the Chemical Society 1948, P170-3 CAPLUS
  3. (7) Demerseman, Pierre; Journal of Heterocyclic Chemistry 1985, V22(1), P39-43 CAPLUS
  4. (8) Profft, Elmar; Chemische Berichte 1961, V94, P2374-82 CAPLUS
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