chempirical

Terephthalamide

C8H8N2O2CAS 3010-82-0164.16 g/mol

Open in Covalent MOL file
H2NONH2O
Amide

Properties

Molecular formula
C8H8N2O2
Molar mass
164.16 g/mol
Exact mass
164.0586 Da
Melting point
200 °C (decomposes)
logP
-0.12Crippen estimate
Polar surface area
86.2 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
2

Identifiers

CAS number
3010-82-0
SMILES
NC(=O)c1ccc(C(N)=O)cc1
InChIKey
MHSKRLJMQQNJNC-UHFFFAOYSA-N
InChI
InChI=1S/C8H8N2O2/c9-7(11)5-1-2-6(4-3-5)8(10)12/h1-4H,(H2,9,11)(H2,10,12)

Weigh it out

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

Names and synonyms

8 names
  • 1,4-Benzenedicarboxamide
  • Terephthalic acid diamide
  • p-Phthalamide
  • Terephthalamimidic acid
  • Terephthaldiamide
  • p-Carbamoylbenzamide
  • Terephthalic diamide
  • NSC 56420

Work with Terephthalamide

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

4-Aminobenzamide2835-68-974 % similar 4-Methylbenzamide619-55-670 % similar 4-Chlorobenzamide619-56-770 % similar 4-Hydroxybenzamide619-57-870 % similar 4-Bromobenzamide698-67-970 % similar 4-Fluorobenzamide824-75-970 % similar 4-(Aminocarbonyl)benzoic acid6051-43-067 % similar Isonicotinamide1453-82-365 % similar

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

Same formula

1,3-Benzenedicarboxamide1740-57-4 6-Nitroindoline19727-83-4 1,2-Dihydro-6-hydroxy-1,4-dimethyl-2-oxo-3-pyridinecarbonitrile27074-03-9 5-Nitroindoline32692-19-6 Phthalamide88-96-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook