Compound C29H53NO5

1-(3-hexyl-4-oxooxetan-2-yl)tridecan-2-yl 2-formamido-4-methylpentanoate

CAS: 111466-62-7

Molecular Formula	`C29H53NO5`
Molecular Weight	495.7 g/mol
LogP	10.0
Topological Polar Surface Area	81.7 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	5
Rotatable Bonds	23
Exact Mass	495.39236
Heavy Atoms	35
Complexity	579.0

Chemical Identifiers

CAS Number	111466-62-7
SMILES	`CCCCCCCCCCCC(CC1C(C(=O)O1)CCCCCC)OC(=O)C(CC(C)C)NC=O`
InChIKey	`AHLBNYSZXLDEJQ-UHFFFAOYSA-N`

📖 Product Overview

Compound C29H53NO5 (CAS: 111466-62-7) is a chemical compound with molecular formula C29H53NO5 and molecular weight 495.7 g/mol. Its IUPAC systematic name is 1-(3-hexyl-4-oxooxetan-2-yl)tridecan-2-yl 2-formamido-4-methylpentanoate. LogP 10.0 Topological Polar Surface Area 81.7 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 5 Rotatable Bonds 23 Exact Mass 495.39236 Heavy Atoms 35 Complexity 579.0 InChI Key: AHLBNYSZXLDEJQ-UHFFFAOYSA-N. SMILES: CCCCCCCCCCCC(CC1C(C(=O)O1)CCCCCC)OC(=O)C(CC(C)C)NC=O.

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