Cerotic acid

C₂₆H₅₂O₂CAS 506-46-7396.70 g/mol

Open in Covalent MOL file

Carboxylic acid

Properties

Molecular formula: C₂₆H₅₂O₂
Molar mass: 396.70 g/mol
Exact mass: 396.3967 Da
Melting point: 88.5 °C
logP: 9.45Crippen estimate
Polar surface area: 37.3 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 24

Hazards

Warning

H315 Causes skin irritation33.3% of notifiers
H319 Causes serious eye irritation33.3% of notifiers
H335 May cause respiratory irritation33.3% of notifiers

Aggregated from 3 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

506-46-7

SMILES

CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O

InChIKey

XMHIUKTWLZUKEX-UHFFFAOYSA-N

InChI

InChI=1S/C26H52O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26(27)28/h2-25H2,1H3,(H,27,28)

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Names and synonyms

7 names

Hexacosanoic acid
Cerinic acid
Ceratinic acid
Ceric acid
n-Hexacosanoic acid
Cerylic acid
NSC 4205

Work with Cerotic acid

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

Pentadecylic acid1002-84-2100 % similar Enanthic acid111-14-8100 % similar Pelargonic acid112-05-0100 % similar Undecylic acid112-37-8100 % similar Behenic acid112-85-6100 % similar Caprylic acid124-07-2100 % similar Lauric acid143-07-7100 % similar Heneicosylic acid2363-71-5100 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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