Vanillylamine, N-heptanoyl-, acetate

[4-[(heptanoylamino)methyl]-2-methoxyphenyl] acetate

CAS: 101030-69-7

Molecular Formula	`C17H25NO4`
Molecular Weight	307.4 g/mol
LogP	3.2
Topological Polar Surface Area	64.6 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	10
Exact Mass	307.17834
Heavy Atoms	22
Complexity	346.0

Chemical Identifiers

CAS Number	101030-69-7
SMILES	`CCCCCCC(=O)NCC1=CC(=C(C=C1)OC(=O)C)OC`
InChIKey	`MHCUTVAZEAWWON-UHFFFAOYSA-N`

📖 Product Overview

Vanillylamine, N-heptanoyl-, acetate (CAS: 101030-69-7) is a chemical compound with molecular formula C17H25NO4 and molecular weight 307.4 g/mol. Its IUPAC systematic name is [4-[(heptanoylamino)methyl]-2-methoxyphenyl] acetate. LogP 3.2 Topological Polar Surface Area 64.6 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 10 Exact Mass 307.17834 Heavy Atoms 22 Complexity 346.0 InChI Key: MHCUTVAZEAWWON-UHFFFAOYSA-N. SMILES: CCCCCCC(=O)NCC1=CC(=C(C=C1)OC(=O)C)OC.

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