2-Nonenoic acid

C₉H₁₆O₂CAS 3760-11-0156.22 g/mol

Open in Covalent MOL file

Alkene Carboxylic acid

Properties

Molecular formula: C₉H₁₆O₂
Molar mass: 156.22 g/mol
Exact mass: 156.1150 Da
Density: 0.9345 g/mL (at 17.1 °C)
Melting point: 0–1 °C
Boiling point: 220–223 °C
logP: 2.60Crippen estimate
Polar surface area: 37.3 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 6

Identifiers

CAS number

3760-11-0

SMILES

CCCCCCC=CC(=O)O

InChIKey

ADLXTJMPCFOTOO-UHFFFAOYSA-N

InChI

InChI=1S/C9H16O2/c1-2-3-4-5-6-7-8-9(10)11/h7-8H,2-6H2,1H3,(H,10,11)

Weigh it out

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

Names and synonyms

1 names

NSC 32357

Work with 2-Nonenoic 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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

trans-2-Decenoic acid334-49-6100 % similar trans-2-Octenoic acid1871-67-696 % similar 2-Hexenoic acid1191-04-471 % similar trans-2-Hexenoic acid13419-69-771 % similar Queen bee acid14113-05-465 % similar 10-Hydroxy-2-decenoic acid765-01-565 % similar Traumatic acid6402-36-461 % similar 3-Decen-2-one10519-33-259 % similar

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

Same formula

Gamma-nonalactone104-61-0 2,2,6,6-Tetramethyl-2H-3,5,6-trihydropyran-4-one1197-66-6 Allyl hexanoate123-68-2 Olean180-84-7 2,6-Dimethyl-3,5-heptanedione18362-64-6 Hexyl acrylate2499-95-8 4-Hydroxynonenal29343-52-0 Ethyl cyclohexanecarboxylate3289-28-9

Elsewhere

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