chempirical

C,C′-[Methylenebis(2,6-dimethyl-4,1-phenylene)] dicyanate

C19H18N2O2CAS 101657-77-6306.37 g/mol

Open in Covalent MOL file
ONON
EtherNitrile

Properties

Molecular formula
C19H18N2O2
Molar mass
306.37 g/mol
Exact mass
306.1368 Da
logP
4.23Crippen estimate
Polar surface area
66.0 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
4

Identifiers

CAS number
101657-77-6
SMILES
Cc1cc(Cc2cc(C)c(OC#N)c(C)c2)cc(C)c1OC#N
InChIKey
JNCRKOQSRHDNIO-UHFFFAOYSA-N
InChI
InChI=1S/C19H18N2O2/c1-12-5-16(6-13(2)18(12)22-10-20)9-17-7-14(3)19(23-11-21)15(4)8-17/h5-8H,9H2,1-4H3

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Names and synonyms

16 names · show all
  • Cyanic acid, C,C′-[methylenebis(2,6-dimethyl-4,1-phenylene)] ester
  • Cyanic acid, methylenebis(2,6-dimethyl-4,1-phenylene) ester
  • AroCy M 10
  • AroCy RDX 64833
  • Bis(4-cyanato-3,5-dimethylphenyl)methane
  • Bis(3,5-dimethyl-4-cyanatophenyl)methane
  • AroCy M 50
  • AroCy M 40S
  • AroCy M 30
  • AroCy M 20
  • M 10
  • M 20
  • M 30
  • 4,4′-Methylenebis(2,6-dimethylphenyl) dicyanate
  • 4,4′-Methylenebis(2,6-dimethylphenyl cyanate)
  • Primaset MethylCy

Work with C,C′-[Methylenebis(2,6-dimethyl-4,1-phenylene)] dicyanate

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

4,4′-Methylenebis(2,6-dimethylaniline)4073-98-742 % similar 4,4′-Diamino-3,3′-dimethyldiphenylmethane838-88-034 % similar

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

Same formula

2-Benzoyl-1,2,3,6,7,11B-hexahydro-4H-pyrazino[2,1-A]isoquinolin-4-one54761-87-4

Elsewhere

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