chempirical

Methylnaphthalene

C11H10CAS 1321-94-4142.20 g/mol

Open in Covalent MOL file

Properties

Molecular formula
C11H10
Molar mass
142.20 g/mol
Exact mass
142.0783 Da
Density
1.0201 g/mL (at 20 °C)
Melting point
34 °C
Boiling point
240 °C
logP
3.15Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
0

Identifiers

CAS number
1321-94-4
SMILES
CC1=CC=CC2=CC=CC=C12
InChIKey
QPUYECUOLPXSFR-UHFFFAOYSA-N
InChI
InChI=1S/C11H10/c1-9-5-4-7-10-6-2-3-8-11(9)10/h2-8H,1H3

Weigh it out

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

Names and synonyms

6 names
  • Naphthalene, methyl-
  • Tetrosin MNLF
  • Dycar MN
  • Monomethylnaphthalene
  • Sure-sol 187
  • 1-Methylnaphthalene

Work with Methylnaphthalene

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1,5-Dimethylnaphthalene571-61-968 % similar 1,4-Dimethylnaphthalene571-58-460 % similar 2,3,5-Trimethylnaphthalene2245-38-758 % similar 1,7-Dimethylnaphthalene575-37-158 % similar 1,6-Dimethylnaphthalene575-43-958 % similar 1,2-Dimethylnaphthalene573-98-856 % similar 1,8-Dimethylnaphthalene569-41-555 % similar 1,3-Dimethylnaphthalene575-41-754 % similar

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

Same formula

1,6-Methano[10]annulene2443-46-1 1-Methylnaphthalene90-12-0 2-Methylnaphthalene91-57-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook