4-{[2,4,5-tris(4-formylphenoxymethyl)phenyl]methoxy}benzaldehyde

4-{[2,4,5-tris(4-formylphenoxymethyl)phenyl]methoxy}benzaldehyde

CAS: 1024915-91-0

Formula: C38H30O8

SMILES: O=CC1=CC=C(OCC2=CC(COC3=CC=C(C=O)C=C3)=C(COC3=CC=C(C=O)C=C3)C=C2COC2=CC=C(C=O)C=C2)C=C1

IUPAC: 4-({2,4,5-tris[(4-formylphenoxy)methyl]phenyl}methoxy)benzaldehyde

InChI: InChI=1S/C38H30O8/c39-19-27-1-9-35(10-2-27)43-23-31-17-33(25-45-37-13-5-29(21-41)6-14-37)34(26-46-38-15-7-30(22-42)8-16-38)18-32(31)24-44-36-11-3-28(20-40)4-12-36/h1-22H,23-26H2

Composition: C (74.26%), H (4.92%), O (20.82%)

Molar Mass: 614.65

Atom Count: 76

Heavy Atom Count: 46

Properties

Properties

Common Names	N/A
Aromatic Ring Count	5
Asymmetric Atom Count	0
Exact Mass	614.194067926
Formal Charge	0
FSP3	0.11
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	0
InChIKey	VRPFKGDAHHZEAZ-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	176.7
Topological Polar Surface Area	105.2
Polarizability	66.33
Ring Count	5
Rotatable Bond Count	16

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