(S)-(-)-2,2'-Dimethoxy-1,1'-binaphthalene

C₂₂H₁₈O₂CAS 75640-87-8314.38 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₂₂H₁₈O₂
Molar mass: 314.38 g/mol
Exact mass: 314.1307 Da
logP: 5.68Crippen estimate
Polar surface area: 18.5 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 3

Hazards

Danger

H315 Causes skin irritation100% of notifiers
H318 Causes serious eye damage90.7% of notifiers
H335 May cause respiratory irritation100% of notifiers
H400 Very toxic to aquatic life100% of notifiers
H410 Very toxic to aquatic life with long lasting effects100% of notifiers

Aggregated from 43 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+P354+P338, P317, P319, P321, P332+P317, P362+P364, P391, P403+P233, P405, P501

Identifiers

CAS number

75640-87-8

SMILES

COC1=C(C2=CC=CC=C2C=C1)C3=C(C=CC4=CC=CC=C43)OC

InChIKey

BJAADAKPADTRCH-UHFFFAOYSA-N

InChI

InChI=1S/C22H18O2/c1-23-19-13-11-15-7-3-5-9-17(15)21(19)22-18-10-6-4-8-16(18)12-14-20(22)24-2/h3-14H,1-2H3

Weigh it out

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

Names and synonyms

1 names

2,2'-Dimethoxy-1,1'-binaphthyl

Work with (S)-(-)-2,2'-Dimethoxy-1,1'-binaphthalene

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

2,2'-Dimethoxy-1,1'-binaphthyl35294-28-1 (R)-(+)-2,2'-Dimethoxy-1,1'-binaphthyl75685-01-7

Similar compounds

(2'-Methoxy-1,1'-binaphthalen-2-yl)(diphenyl)phosphine134484-36-968 % similar (R)-Mop145964-33-668 % similar 1-Bromo-2-methoxynaphthalene3401-47-663 % similar 1-Methoxynaphthalene2216-69-563 % similar 1,4-Dimethoxynaphthalene10075-62-460 % similar (R)-2,2'-Bis(methoxymethoxy)-1,1'-binaphthalene173831-50-059 % similar (2-Methoxy-1-naphthyl)boronic acid104116-17-858 % similar 2-Methoxy-1-naphthaldehyde5392-12-158 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook