Compound C30H34NO3+

[8-methyl-8-[(4-phenylphenyl)methyl]-8-azoniabicyclo[3.2.1]octan-3-yl] 3-hydroxy-2-phenylpropanoate

CAS: 38971-12-9

Molecular Formula	`C30H34NO3+`
Molecular Weight	456.6 g/mol
LogP	5.0
Topological Polar Surface Area	46.5 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	8
Exact Mass	456.25388
Heavy Atoms	34
Complexity	646.0

Chemical Identifiers

CAS Number	38971-12-9
SMILES	`C[N+]1(C2CCC1CC(C2)OC(=O)C(CO)C3=CC=CC=C3)CC4=CC=C(C=C4)C5=CC=CC=C5`
InChIKey	`QDCILXFPWMMNQY-UHFFFAOYSA-N`

📖 Product Overview

Compound C30H34NO3+ (CAS: 38971-12-9) is a chemical compound with molecular formula C30H34NO3+ and molecular weight 456.6 g/mol. Its IUPAC systematic name is [8-methyl-8-[(4-phenylphenyl)methyl]-8-azoniabicyclo[3.2.1]octan-3-yl] 3-hydroxy-2-phenylpropanoate. LogP 5.0 Topological Polar Surface Area 46.5 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 8 Exact Mass 456.25388 Heavy Atoms 34 Complexity 646.0 InChI Key: QDCILXFPWMMNQY-UHFFFAOYSA-N. SMILES: C[N+]1(C2CCC1CC(C2)OC(=O)C(CO)C3=CC=CC=C3)CC4=CC=C(C=C4)C5=CC=CC=C5.

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