2-Methyldecane-2,5-diol

C₁₁H₂₄O₂CAS 53731-34-3188.31 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₁H₂₄O₂
Molar mass: 188.31 g/mol
Exact mass: 188.1776 Da
logP: 2.48Crippen estimate
Polar surface area: 40.5 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 7

Identifiers

CAS number

53731-34-3

SMILES

CCCCCC(CCC(C)(C)O)O

InChIKey

UCIRNJYORXCGHC-UHFFFAOYSA-N

InChI

InChI=1S/C11H24O2/c1-4-5-6-7-10(12)8-9-11(2,3)13/h10,12-13H,4-9H2,1-3H3

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Names and synonyms

2 names

2-Methyl-2,5-decanediol
2-Methyl-decane-2,5-diol

Work with 2-Methyldecane-2,5-diol

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

6-Undecanol23708-56-763 % similar 4-Nonanol5932-79-659 % similar 2-Methyl-2-hexanol625-23-057 % similar 4-Decanol2051-31-257 % similar 3-Octanol20296-29-152 % similar 3-Octanol589-98-052 % similar 3-Decanol1565-81-750 % similar 3-Nonanol624-51-150 % similar

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

Same formula

2,2-Dibutoxypropane141-72-0 1,11-Undecanediol765-04-8

Elsewhere

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