Methyl o-benzoylbenzoate

C15H12O3CAS 606-28-0240.26 g/mol

Open in Covalent MOL file
OOO
EsterKetone

Properties

Molecular formula
C15H12O3
Molar mass
240.26 g/mol
Exact mass
240.0786 Da
Melting point
52 °C
Boiling point
351 °C
logP
2.70Crippen estimate
Polar surface area
43.4 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
3

Hazards

Aggregated from 2,297 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P273, P501

Identifiers

CAS number
606-28-0
SMILES
COC(=O)c1ccccc1C(=O)c1ccccc1
InChIKey
NQSMEZJWJJVYOI-UHFFFAOYSA-N
InChI
InChI=1S/C15H12O3/c1-18-15(17)13-10-6-5-9-12(13)14(16)11-7-3-2-4-8-11/h2-10H,1H3

Weigh it out

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

Names and synonyms

17 names · show all
  • Benzoic acid, 2-benzoyl-, methyl ester
  • Benzoic acid, o-benzoyl-, methyl ester
  • o-(Methoxycarbonyl)benzophenone
  • Methyl 2-benzoylbenzoate
  • Speedcure MBB
  • NSC 3797
  • Initiator 1056
  • OBM 100
  • Daitocure OB
  • OMBB
  • Runtecure 1056
  • SB-PI 711
  • 2-Benzoylbenzoic acid methyl ester
  • Genocure MBB
  • Omnirad OMBB
  • Photoinitiator MOBB
  • PI MBB

Work with Methyl o-benzoylbenzoate

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

Dimethyl phthalate131-11-371 % similar 1,2-Dibenzoylbenzene1159-86-064 % similar Methyl benzoate93-58-363 % similar 2-Methoxybenzophenone2553-04-057 % similar Monomethyl phthalate4376-18-557 % similar Methyl 2-bromobenzoate610-94-656 % similar Methyl 2-methylbenzoate89-71-456 % similar Methyl salicylate119-36-854 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Flurenol-methyl ester1216-44-0 1-(2-Hydroxyphenyl)-3-phenyl-1,3-propanedione1469-94-9 2′-Hydroxyflavanone17348-76-4 3-Benzoylbenzeneacetic acid22071-22-3 1-[2-(Benzoyloxy)phenyl]ethanone4010-33-7 (±)-6-Hydroxyflavanone4250-77-5 7-Hydroxyflavanone6515-36-2 4′-Hydroxyflavanone6515-37-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook