3-(8,13-diethyl-3,7,12,17-tetramethyl-23,24-dihydroporphyrin-2-yl)propanoic acid

CAS: 644-00-8

Molecular Formula	`C31H34N4O2`
Molecular Weight	494.6 g/mol
LogP	4.9
Topological Polar Surface Area	94.7 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	4
Rotatable Bonds	5
Exact Mass	494.2682
Heavy Atoms	37
Complexity	793.0

Chemical Identifiers

CAS Number	644-00-8
SMILES	`CCC1=C2C=C3C(=CC(=CC4=NC(=CC5=NC(=CC(=C1C)N2)C(=C5C)CC)C(=C4CCC(=O)O)C)N3)C`
InChIKey	`QOPJEFQXHWQPTC-UHFFFAOYSA-N`

📖 Product Overview

3-(8,13-diethyl-3,7,12,17-tetramethyl-23,24-dihydroporphyrin-2-yl)propanoic acid (CAS: 644-00-8) is a chemical compound with molecular formula C31H34N4O2 and molecular weight 494.6 g/mol. Its IUPAC systematic name is 3-(8,13-diethyl-3,7,12,17-tetramethyl-23,24-dihydroporphyrin-2-yl)propanoic acid. LogP 4.9 Topological Polar Surface Area 94.7 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 4 Rotatable Bonds 5 Exact Mass 494.2682 Heavy Atoms 37 Complexity 793.0 InChI Key: QOPJEFQXHWQPTC-UHFFFAOYSA-N. SMILES: CCC1=C2C=C3C(=CC(=CC4=NC(=CC5=NC(=CC(=C1C)N2)C(=C5C)CC)C(=C4CCC(=O)O)C)N3)C.

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