Compound C31H25NO4

(11-benzoyloxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-10-yl) benzoate

CAS: 99640-35-4

Molecular Formula	`C31H25NO4`
Molecular Weight	475.5 g/mol
LogP	5.8
Topological Polar Surface Area	55.8 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	5
Rotatable Bonds	6
Exact Mass	475.17834
Heavy Atoms	36
Complexity	787.0

Chemical Identifiers

CAS Number	99640-35-4
SMILES	`CN1CCC2=C3C1CC4=C(C3=CC=C2)C(=C(C=C4)OC(=O)C5=CC=CC=C5)OC(=O)C6=CC=CC=C6`
InChIKey	`VBPQTDKFLRFHSL-UHFFFAOYSA-N`

📖 Product Overview

Compound C31H25NO4 (CAS: 99640-35-4) is a chemical compound with molecular formula C31H25NO4 and molecular weight 475.5 g/mol. Its IUPAC systematic name is (11-benzoyloxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-10-yl) benzoate. LogP 5.8 Topological Polar Surface Area 55.8 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 5 Rotatable Bonds 6 Exact Mass 475.17834 Heavy Atoms 36 Complexity 787.0 InChI Key: VBPQTDKFLRFHSL-UHFFFAOYSA-N. SMILES: CN1CCC2=C3C1CC4=C(C3=CC=C2)C(=C(C=C4)OC(=O)C5=CC=CC=C5)OC(=O)C6=CC=CC=C6.

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