2-Methoxy-5-methyl-γ-phenylbenzenepropanol

C₁₇H₂₀O₂CAS 124937-73-1256.34 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₇H₂₀O₂
Molar mass: 256.34 g/mol
Exact mass: 256.1463 Da
logP: 3.52Crippen estimate
Polar surface area: 29.5 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 5

Hazards

Warning

H302 Harmful if swallowed75% of notifiers
H312 Harmful in contact with skin75% of notifiers
H332 Harmful if inhaled75% of notifiers

Aggregated from 4 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, P501

Identifiers

CAS number

124937-73-1

SMILES

COc1ccc(C)cc1C(CCO)c1ccccc1

InChIKey

OCGTUTJXBDQGKL-UHFFFAOYSA-N

InChI

InChI=1S/C17H20O2/c1-13-8-9-17(19-2)16(12-13)15(10-11-18)14-6-4-3-5-7-14/h3-9,12,15,18H,10-11H2,1-2H3

Weigh it out

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

Names and synonyms

4 names

Benzenepropanol, 2-methoxy-5-methyl-γ-phenyl-
3-(2-Methoxy-5-methylphenyl)-3-phenylpropan-1-ol
3-(2-Methoxy-5-methylphenyl)-3-phenylpropanol
(3RS)-3-(2-Methoxy-5-methylphenyl)-3-phenylpropan-1-ol

Work with 2-Methoxy-5-methyl-γ-phenylbenzenepropanol

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-Methoxy-5-methyl-β-phenylbenzenepropanoic acid109089-77-263 % similar 2-Methoxy-5-methyl-n,n-bis(1-methylethyl)-gamma-phenylbenzenepropanamine fumarate124935-89-356 % similar 3,4-Dihydro-6-methyl-4-phenyl-2H-1-benzopyran-2-one40546-94-950 % similar γ-Phenylbenzenepropanol20017-67-849 % similar 2-[3-[Bis(1-methylethyl)amino]-1-phenylpropyl]-4-methylphenol124936-74-944 % similar Tolterodine124937-51-544 % similar 3,4-Dimethoxytoluene494-99-541 % similar 2-Methoxy-5-methylphenol1195-09-141 % similar

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

Same formula

4,4'-Methylenebis(2,6-dimethylphenol)5384-21-4 Bisphenol C79-97-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook