chempirical

Dl-thyronine

C15H15NO4CAS 1034-10-2273.29 g/mol

Open in Covalent MOL file
H2NOOHOHO
Carboxylic acidEtherPhenolPrimary amine

Properties

Molecular formula
C15H15NO4
Molar mass
273.29 g/mol
Exact mass
273.1001 Da
logP
2.14Crippen estimate
Polar surface area
92.8 Ų
H-bond donors / acceptors
3 / 4
Rotatable bonds
5

Identifiers

CAS number
1034-10-2
SMILES
NC(Cc1ccc(Oc2ccc(O)cc2)cc1)C(=O)O
InChIKey
KKCIOUWDFWQUBT-UHFFFAOYSA-N
InChI
InChI=1S/C15H15NO4/c16-14(15(18)19)9-10-1-5-12(6-2-10)20-13-7-3-11(17)4-8-13/h1-8,14,17H,9,16H2,(H,18,19)

Weigh it out

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

Names and synonyms

6 names
  • Tyrosine, O-(4-hydroxyphenyl)-
  • Thyronine, DL-
  • O-(4-Hydroxyphenyl)tyrosine
  • O-(4-Hydroxyphenyl)-DL-tyrosine
  • 2-Amino-3-[4-(4-hydroxyphenoxy)phenyl]propanoic acid
  • 2-Amino-3-(4-(4-hydroxyphenoxy)phenyl)propanoicacid

Work with Dl-thyronine

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

D-Tyrosine556-02-582 % similar Dl-tyrosine556-03-682 % similar Tyrosine60-18-482 % similar Tyrosine hydrochloride16870-43-276 % similar Diiodothyronine1041-01-669 % similar O-Methyl-D-tyrosine39878-65-468 % similar O-Methyl-L-tyrosine6230-11-168 % similar 4-Bromophenylalanine14091-15-764 % similar

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

Same formula

Thyronine1596-67-4

Elsewhere

PubChem CAS Common Chemistry NIST WebBook