Benzo[rst]pentaphene-5-carbaldehyde

hexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2,4,6,8,10,12,14,16,18,20(24),21-dodecaene-8-carbaldehyde

CAS: 63040-53-9

Molecular Formula	`C25H14O`
Molecular Weight	330.4 g/mol
LogP	6.7
Topological Polar Surface Area	17.1 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	1
Rotatable Bonds	1
Exact Mass	330.10446
Heavy Atoms	26
Complexity	554.0

Chemical Identifiers

CAS Number	63040-53-9
SMILES	`C1=CC=C2C3=C4C(=CC2=C1)C=CC5=C(C6=CC=CC=C6C(=C54)C=C3)C=O`
InChIKey	`KXXBSQCVRSXSMB-UHFFFAOYSA-N`

📖 Product Overview

Benzo[rst]pentaphene-5-carbaldehyde (CAS: 63040-53-9) is a chemical compound with molecular formula C25H14O and molecular weight 330.4 g/mol. Its IUPAC systematic name is hexacyclo[10.10.2.02,7.09,23.014,19.020,24]tetracosa-1(23),2,4,6,8,10,12,14,16,18,20(24),21-dodecaene-8-carbaldehyde. LogP 6.7 Topological Polar Surface Area 17.1 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 1 Rotatable Bonds 1 Exact Mass 330.10446 Heavy Atoms 26 Complexity 554.0 InChI Key: KXXBSQCVRSXSMB-UHFFFAOYSA-N. SMILES: C1=CC=C2C3=C4C(=CC2=C1)C=CC5=C(C6=CC=CC=C6C(=C54)C=C3)C=O.

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