chempirical

D-Camphoric acid

C10H16O4CAS 124-83-4200.23 g/mol

Open in Covalent MOL file
OOHOHO
Carboxylic acid

Properties

Molecular formula
C10H16O4
Molar mass
200.23 g/mol
Exact mass
200.1049 Da
Melting point
189.1 °C
logP
1.60Crippen estimate
Polar surface area
74.6 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
2
Stereocentres
S, Rin SMILES atom order

Identifiers

CAS number
124-83-4
SMILES
CC1(C)[C@@H](C(=O)O)CC[C@@]1(C)C(=O)O
InChIKey
LSPHULWDVZXLIL-LDWIPMOCSA-N
InChI
InChI=1S/C10H16O4/c1-9(2)6(7(11)12)4-5-10(9,3)8(13)14/h6H,4-5H2,1-3H3,(H,11,12)(H,13,14)/t6-,10+/m1/s1

Weigh it out

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

Names and synonyms

13 names · show all
  • 1,3-Cyclopentanedicarboxylic acid, 1,2,2-trimethyl-, (1R,3S)-
  • Camphoric acid, (1R,3S)-(+)-
  • 1,3-Cyclopentanedicarboxylic acid, 1,2,2-trimethyl-, (1R-cis)-
  • (1R,3S)-1,2,2-Trimethyl-1,3-cyclopentanedicarboxylic acid
  • Dextrocamphoric acid
  • d-(+)-Camphoric acid
  • (+)-Camphoric acid
  • (1R)-cis-Camphoric acid
  • (+)-(1R,3S)-1,2,2-Trimethyl-1,3-cyclopentanedicarboxylic acid
  • (1R,3S)-Camphoric acid
  • (1R,3S)-(+)-cis-1,2,2-Trimethylcyclopentane-1,3-dicarboxylic acid
  • (1R,3S)-1,2,2-Trimethylcyclopentane-1,3-dicarboxylic acid
  • (1R,3S)-(+)-Camphoric acid

Work with D-Camphoric acid

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

Camphoric acid560-09-8100 % similar (-)-Camphorquinone10334-26-647 % similar Camphorquinone10373-78-147 % similar (+)-Camphorquinone2767-84-247 % similar Camphorquinone465-29-247 % similar 1,8,8-Trimethyl-3-oxabicyclo[3.2.1]octane-2,4-dione595-30-244 % similar 1,8,8-Trimethyl-3-oxabicyclo[3.2.1]octane-2,4-dione76-32-444 % similar 2,2,3,3-Tetramethylcyclopropanecarboxylic acid15641-58-441 % similar

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

Same formula

4-(2-Oxiranylmethoxy)butyl 2-propenoate119692-59-0 3,3,6,6-Tetramethoxycyclohexa-1,4-diene15791-03-4 Diethyl allylmalonate2049-80-1 1,4-Dipropyl (2Z)-2-butenedioate2432-63-5 Ethyl 4-acetyl-5-oxohexanoate2832-10-2 1,4-Dimethyl trans-1,4-cyclohexanedicarboxylate3399-22-2 Diethyl 1,1-cyclobutanedicarboxylate3779-29-1 1,1-Cyclohexanediacetic acid4355-11-7

Elsewhere

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