4,4'-Methylenebis(2,6-dimethylphenol)

C₁₇H₂₀O₂CAS 5384-21-4256.34 g/mol

Open in Covalent MOL file

Phenol

Properties

Molecular formula: C₁₇H₂₀O₂
Molar mass: 256.34 g/mol
Exact mass: 256.1463 Da
Melting point: 175 °C
logP: 3.92Crippen estimate
Polar surface area: 40.5 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 2

Hazards

Warning

H315 Causes skin irritation93.3% of notifiers
H319 Causes serious eye irritation93.3% of notifiers
H335 May cause respiratory irritation91.1% of notifiers
H400 Very toxic to aquatic life88.9% of notifiers

Aggregated from 45 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, P501

Identifiers

CAS number

5384-21-4

SMILES

Cc1cc(Cc2cc(C)c(O)c(C)c2)cc(C)c1O

InChIKey

AZZWZMUXHALBCQ-UHFFFAOYSA-N

InChI

InChI=1S/C17H20O2/c1-10-5-14(6-11(2)16(10)18)9-15-7-12(3)17(19)13(4)8-15/h5-8,18-19H,9H2,1-4H3

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Names and synonyms

14 names · show all

Tetramethyl bisphenol F
Phenol, 4,4′-methylenebis[2,6-dimethyl-
2,6-Xylenol, 4,4′-methylenedi-
4,4′-Methylenebis[2,6-dimethylphenol]
3,3′,5,5′-Tetramethyl-4,4′-dihydroxydiphenylmethane
4,4′-Methylenedi-2,6-xylenol
4,4′-Dihydroxy-3,3′,5,5′-tetramethyldiphenylmethane
Bis(4-hydroxy-3,5-dimethylphenyl)methane
4,4′-Methylenebis[2,6-xylenol]
Bis(3,5-dimethyl-4-hydroxyphenyl)methane
4,4′-Methylenebis(2,6-dimethylphenol)
Desoxon M
TMBPF
NSC 128403

Work with 4,4'-Methylenebis(2,6-dimethylphenol)

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

4-(Aminomethyl)-2,6-dimethylphenol876-15-364 % similar 3,3',5,5'-Tetramethylbiphenyl-4,4'-diol2417-04-159 % similar Mesitol527-60-657 % similar 2,6-Dimethylhydroquinone654-42-257 % similar 4-Iodo-2,6-dimethylphenol10570-67-954 % similar 4-Chloro-2,6-dimethylphenol1123-63-352 % similar 4-Bromo-2,6-dimethylphenol2374-05-252 % similar 4,4′-Methylenebis(2,6-dimethylaniline)4073-98-752 % similar

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

Same formula

2-Methoxy-5-methyl-γ-phenylbenzenepropanol124937-73-1 Bisphenol C79-97-0

Elsewhere

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