chempirical

2,3,4,5,6-Pentamethylbenzophenone

C18H20OCAS 20386-33-8252.36 g/mol

Open in Covalent MOL file
O
Ketone

Properties

Molecular formula
C18H20O
Molar mass
252.36 g/mol
Exact mass
252.1514 Da
logP
4.46Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
2

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
20386-33-8
SMILES
CC1=C(C(=C(C(=C1C)C)C(=O)C2=CC=CC=C2)C)C
InChIKey
JFFVBXWGARSRSC-UHFFFAOYSA-N
InChI
InChI=1S/C18H20O/c1-11-12(2)14(4)17(15(5)13(11)3)18(19)16-9-7-6-8-10-16/h6-10H,1-5H3

Weigh it out

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

Work with 2,3,4,5,6-Pentamethylbenzophenone

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

Benzophenone119-61-958 % similar 2,4,6-Trimethylbenzophenone954-16-556 % similar 1,4-Dibenzoylbenzene3016-97-556 % similar 4-Methylbenzophenone134-84-955 % similar 2,3,4,5,6-Pentafluorobenzophenone1536-23-853 % similar 1,2-Dibenzoylbenzene1159-86-052 % similar 1,3,5-Tribenzoylbenzene25871-69-652 % similar 2-Methylbenzophenone131-58-852 % similar

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

Elsewhere

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