Benzo[b]thiophene-2-carboxylic hydrazide

C9H8N2OSCAS 175135-07-6192.24 g/mol

Open in Covalent MOL file
H2NNHOS
HydrazonePrimary amine

Properties

Molecular formula
C9H8N2OS
Molar mass
192.24 g/mol
Exact mass
192.0357 Da
logP
2.08Crippen estimate
Polar surface area
58.6 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 5 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
175135-07-6
SMILES
NN=C(O)c1cc2ccccc2s1
InChIKey
ZXKPFIRPUUAAPQ-UHFFFAOYSA-N
InChI
InChI=1S/C9H8N2OS/c10-11-9(12)8-5-6-3-1-2-4-7(6)13-8/h1-5H,10H2,(H,11,12)

Weigh it out

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

Names and synonyms

2 names
  • Benzo[B]thiophene-2-carboxylic acid, hydrazide
  • 1-Benzothiophene-2-carbohydrazide

Work with Benzo[b]thiophene-2-carboxylic hydrazide

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

Benzo[b]thiophene-2-carboxylic acid6314-28-954 % similar 2-Naphthohydrazide39627-84-450 % similar Thianaphthene-2-carboxamide6314-42-750 % similar 3-Hydroxy-2-naphthoic acid hydrazide5341-58-248 % similar 2-Acetylbenzothiophene22720-75-846 % similar Benzo[B]thiophene-2-carbonyl chloride39827-11-746 % similar 1-Naphthohydrazide43038-45-546 % similar Benzoylhydrazine613-94-546 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Furfuryl thiopyrazine164352-93-6 Phenylthiohydantoin2010-15-3

Elsewhere

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