Sodium N-[8-(2-hydroxybenzoyl)amino]caprylate

C₁₅H₂₀NNaO₄CAS 203787-91-1301.32 g/mol

Open in Covalent MOL file

Carboxylic acid Phenol

Properties

Molecular formula: C₁₅H₂₀NNaO₄
Molar mass: 301.32 g/mol
Exact mass: 301.1290 Da
logP: 2.74Crippen estimate
Polar surface area: 90.1 Å²
H-bond donors / acceptors: 3 / 3
Rotatable bonds: 9

Identifiers

CAS number

203787-91-1

SMILES

[O-]C(=O)CCCCCCCNC(=O)c1ccccc1O.[Na+]

InChIKey

RYXLCKUMPSGTIX-UHFFFAOYSA-N

InChI

InChI=1S/C15H21NO4.Na/c17-13-9-6-5-8-12(13)15(20)16-11-7-3-1-2-4-10-14(18)19;/h5-6,8-9,17H,1-4,7,10-11H2,(H,16,20)(H,18,19);

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

8 names

Octanoic acid, 8-[(2-hydroxybenzoyl)amino]-, sodium salt (1:1)
Octanoic acid, 8-[(2-hydroxybenzoyl)amino]-, monosodium salt
Sodium 8-(salicyloylamino)octanoate
SNAC
Salcaprozate sodium
E 414
Sodium 8-[(2-hydroxybenzoyl)amino]caprylate
Sodium 8-[(2-hydroxybenzoyl)amino]octanoate

Work with Sodium N-[8-(2-hydroxybenzoyl)amino]caprylate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Picamilon62936-56-550 % similar Balsalazide disodium hydrate150399-21-649 % similar Sodium phenylbutyrate1716-12-746 % similar Sodium salicylate54-21-746 % similar Disodium sebacate17265-14-444 % similar Osalmid526-18-142 % similar Sodium hippurate532-94-542 % similar Sodium caprate1002-62-638 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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