chempirical

(-)-1,2,3,4-Tetrahydronaphthalene-1-carboxylic acid

C11H12O2CAS 85977-52-2176.22 g/mol

Open in Covalent MOL file
OHO
AlcoholCarboxylic Acid

Properties

Molecular formula
C11H12O2
Molar mass
176.22 g/mol
Exact mass
176.0837 Da
logP
2.19Crippen estimate
Polar surface area
37.3 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Identifiers

CAS number
85977-52-2
SMILES
O=C(O)[C@H]1CCCc2ccccc21
InChIKey
VDLWTJCSPSUGOA-JTQLQIEISA-N
InChI
InChI=1S/C11H12O2/c12-11(13)10-7-3-5-8-4-1-2-6-9(8)10/h1-2,4,6,10H,3,5,7H2,(H,12,13)/t10-/m0/s1

Weigh it out

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

Names and synonyms

7 names
  • D-(-)-1,2,3,4-Tetrahydro-1-naphthoic acid
  • 1-Naphthalenecarboxylic acid, 1,2,3,4-tetrahydro-, (1S)-
  • 1-Naphthalenecarboxylic acid, 1,2,3,4-tetrahydro-, (S)-
  • (1S)-1,2,3,4-Tetrahydro-1-naphthalenecarboxylic acid
  • (S)-1,2,3,4-Tetrahydro-1-naphthoic acid
  • (S)-1,2,3,4-Tetrahydronaphthalene-1-carboxylic acid
  • (1S)-1,2,3,4-Tetrahydronaphthalene-1-carboxylic acid

Work with (-)-1,2,3,4-Tetrahydronaphthalene-1-carboxylic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Same formula

Ethyl cinnamate103-36-6 Cinnamyl acetate103-54-8 6-Methoxy-1-tetralone1078-19-9 5,6,7,8-Tetrahydro-2-naphthoic acid1131-63-1 Allyl phenylacetate1797-74-6 2-Methyl-1-phenyl-3-butyne-1,2-diol2033-94-5 (+)-1,2,3,4-Tetrahydronaphthalene-1-carboxylic acid23357-47-3 6-Methoxy-2-tetralone2472-22-2

Elsewhere

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