chempirical

1,3-Bis(2-hydroxyethoxy)benzene

C10H14O4CAS 102-40-9198.22 g/mol

Open in Covalent MOL file
OHOOHO
AlcoholEther

Properties

Molecular formula
C10H14O4
Molar mass
198.22 g/mol
Exact mass
198.0892 Da
Melting point
95–96 °C
logP
0.43Crippen estimate
Polar surface area
58.9 Ų
H-bond donors / acceptors
2 / 4
Rotatable bonds
6

Identifiers

CAS number
102-40-9
SMILES
OCCOc1cccc(OCCO)c1
InChIKey
IAXFZZHBFXRZMT-UHFFFAOYSA-N
InChI
InChI=1S/C10H14O4/c11-4-6-13-9-2-1-3-10(8-9)14-7-5-12/h1-3,8,11-12H,4-7H2

Weigh it out

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

Names and synonyms

18 names · show all
  • RE 2
  • m-Di(2-hydroxyethoxy)benzene
  • 1,3-Dihydroxybenzene di(2-hydroxyethyl) ether
  • Ethanol, 2,2′-[1,3-phenylenebis(oxy)]bis-
  • Ethanol, 2,2′-(m-phenylenedioxy)di-
  • 2,2′-[1,3-Phenylenebis(oxy)]bis[ethanol]
  • 2,2′-(m-Phenylenedioxy)diethanol
  • m-Bis(2-hydroxyethoxy)benzene
  • Resorcinol bis(β-hydroxyethyl) ether
  • Resorcinol bis(2-hydroxyethyl) ether
  • O,O-Bis(β-hydroxyethyl)resorcinol
  • HER HP
  • NSC 65613
  • 1,3-Dihydroxybenzene bis(2-hydroxyethyl) ether
  • 2,2′-[1,3-Phenylenebis(oxy)diethanol
  • HER
  • 1,3-Di(2-hydroxyethoxy)benzene
  • 2-[3-(2-Hydroxyethoxy)phenoxy]ethanol

Work with 1,3-Bis(2-hydroxyethoxy)benzene

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-(3-Methylphenoxy)ethanol13605-19-171 % similar Phenoxyethanol122-99-671 % similar 3-(2-Hydroxyethoxy)benzaldehyde60345-97-365 % similar 2-(2-Naphthoxy)ethanol93-20-962 % similar 2-(4-Chlorophenoxy)ethanol1892-43-957 % similar 1,3-Diethoxybenzene2049-73-254 % similar 3-Phenoxy-1-propanol6180-61-654 % similar 2-(2-Chlorophenoxy)ethanol15480-00-953 % similar

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

Same formula

Hydroquinone bis(2-hydroxyethyl) ether104-38-1 1,4-Butylene glycol diacrylate1070-70-8 4,5-Dihydro-2,5-dimethyl-4-oxo-3-furanyl butanoate114099-96-6 (1S,4R)-4,7,7-Trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxylic acid13429-83-9 Polyethylene glycol dimethacrylate25852-47-5 3,4,5-Trimethoxybenzyl alcohol3840-31-1 Divinyl adipate4074-90-2 2,3,4-Trimethoxybenzyl alcohol71989-96-3

Elsewhere

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