chempirical

Vitamin K4

C15H14O4CAS 573-20-6258.27 g/mol

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Ester

Properties

Molecular formula
C15H14O4
Molar mass
258.27 g/mol
Exact mass
258.0892 Da
Melting point
113 °C
logP
3.00Crippen estimate
Polar surface area
52.6 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
2

Hazards

Danger
Corrosive (GHS05)

Aggregated from 42 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264+P265, P280, P305+P354+P338, P317

Identifiers

CAS number
573-20-6
SMILES
CC(=O)Oc1cc(C)c(OC(C)=O)c2ccccc12
InChIKey
RYWSYCQQUDFMAU-UHFFFAOYSA-N
InChI
InChI=1S/C15H14O4/c1-9-8-14(18-10(2)16)12-6-4-5-7-13(12)15(9)19-11(3)17/h4-8H,1-3H3

Weigh it out

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

Names and synonyms

22 names · show all
  • Kapathrom
  • 1,4-Naphthalenediol, 2-methyl-, 1,4-diacetate
  • 1,4-Naphthalenediol, 2-methyl-, diacetate
  • Davitamon-K
  • 1,4-Diacetoxy-2-methylnaphthalene
  • Kapilin
  • Kapilon
  • Kappaxan
  • Kativ powder
  • Kayvite
  • Menadiol diacetate
  • 2-Methyl-1,4-naphthohydroquinone diacetate
  • Prokayvit oral
  • Vitamin K diacetate
  • Vitavel K
  • Acetomenaphthone
  • Adaprin
  • Pafavit
  • Davitamon-K-oral
  • 2-Methyl-1,4-naphthoquinol diacetate
  • NSC 403062
  • Acetomenaphtone

Work with Vitamin K4

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

Menadiol monoacetate2211-27-069 % similar 1-Acetoxy-2-methylnaphthalene5697-02-962 % similar 2-Methylphenyl acetate533-18-658 % similar Pyrogallol triacetate525-52-053 % similar 1-Naphthyl acetate830-81-951 % similar 1-Benzofuran-3-yl acetate93680-80-951 % similar 2,5-Diacetoxytoluene717-27-150 % similar 2-Chlorophenyl acetate4525-75-149 % similar

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

Same formula

3′,4′-Dimethoxy[1,1′-biphenyl]-4-carboxylic acid122294-10-4 4-(Benzyloxy)-3-methoxybenzoic acid1486-53-9 Murrayone19668-69-0 Isorhapontigenin32507-66-7 Menbutone3562-99-0 (4-(Phenylmethoxy)phenoxy)acetic acid38559-92-1 2,4-Dimethoxy-4'-hydroxybenzophenone41351-30-8 Yangonin500-62-9

Elsewhere

PubChem CAS Common Chemistry NIST WebBook