3,4-Epoxy-1,2,3,4-tetrahydrochrysene

4-oxapentacyclo[9.8.0.02,8.03,5.012,17]nonadeca-1(11),2(8),9,12,14,16,18-heptaene

CAS: 67694-88-6

Molecular Formula	`C18H14O`
Molecular Weight	246.3 g/mol
LogP	4.3
Topological Polar Surface Area	12.5 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	1
Rotatable Bonds	0
Exact Mass	246.10446
Heavy Atoms	19
Complexity	365.0

Chemical Identifiers

CAS Number	67694-88-6
SMILES	`C1CC2=C(C3C1O3)C4=C(C=C2)C5=CC=CC=C5C=C4`
InChIKey	`QACFNHCNHLHKBN-UHFFFAOYSA-N`

📖 Product Overview

3,4-Epoxy-1,2,3,4-tetrahydrochrysene (CAS: 67694-88-6) is a chemical compound with molecular formula C18H14O and molecular weight 246.3 g/mol. Its IUPAC systematic name is 4-oxapentacyclo[9.8.0.02,8.03,5.012,17]nonadeca-1(11),2(8),9,12,14,16,18-heptaene. LogP 4.3 Topological Polar Surface Area 12.5 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 1 Rotatable Bonds 0 Exact Mass 246.10446 Heavy Atoms 19 Complexity 365.0 InChI Key: QACFNHCNHLHKBN-UHFFFAOYSA-N. SMILES: C1CC2=C(C3C1O3)C4=C(C=C2)C5=CC=CC=C5C=C4.

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