4-Methyl-5-nonanol

C₁₀H₂₂OCAS 154170-44-2158.28 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₀H₂₂O
Molar mass: 158.28 g/mol
Exact mass: 158.1671 Da
logP: 2.97Crippen estimate
Polar surface area: 20.2 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 6

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers

Aggregated from 29 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364

Identifiers

CAS number

154170-44-2

SMILES

CCCCC(O)C(C)CCC

InChIKey

MBZNNOPVFZCHID-UHFFFAOYSA-N

InChI

InChI=1S/C10H22O/c1-4-6-8-10(11)9(3)7-5-2/h9-11H,4-8H2,1-3H3

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Names and synonyms

2 names

5-Nonanol, 4-methyl-
Ferrolure

Work with 4-Methyl-5-nonanol

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

2-Methylcyclohexanol583-59-563 % similar cis-2-Methylcyclohexanol7443-70-163 % similar 2-Methyl-3-hexanol617-29-850 % similar 2,4-Dimethyl-3-heptanol19549-72-548 % similar (R)-(-)-2-Hexanol26549-24-648 % similar 2,3-Dimethylheptane3074-71-348 % similar (S)-(+)-2-Hexanol52019-78-048 % similar 2-Hexanol626-93-748 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Propylheptanol10042-59-8 3,7-Dimethyl-1-octanol106-21-8 (±)-2-Decanol1120-06-5 1-Decanol112-30-1 3-Decanol1565-81-7 Decan-4-ol2051-31-2 3-Methyl-3-nonanol21078-72-8 4-Methyl-4-nonanol23418-38-4

Elsewhere

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