N-(4-Cyanophenyl)guanidine hydrochloride

C₈H₉ClN₄CAS 373690-68-7196.64 g/mol

Open in Covalent MOL file

Guanidine Nitrile

Properties

Molecular formula: C₈H₉ClN₄
Molar mass: 196.64 g/mol
Exact mass: 196.0516 Da
logP: 0.88Crippen estimate
Polar surface area: 88.2 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

373690-68-7

SMILES

C1=CC(=CC=C1C#N)N=C(N)N.Cl

InChIKey

FNUYXKASQONDCV-UHFFFAOYSA-N

InChI

InChI=1S/C8H8N4.ClH/c9-5-6-1-3-7(4-2-6)12-8(10)11;/h1-4H,(H4,10,11,12);1H

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Names and synonyms

1 names

1-(4-Cyanophenyl)guanidine hydrochloride

Work with N-(4-Cyanophenyl)guanidine hydrochloride

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

N-(4-Cyanophenyl)acetamide35704-19-951 % similar 4-Hydrazinobenzonitrile monohydrochloride2863-98-147 % similar 4-(Aminomethyl)benzonitrile hydrochloride15996-76-646 % similar 1,4-Dicyanobenzene623-26-744 % similar 4-Cyanophenyl isothiocyanate2719-32-643 % similar 4-Cyanobenzamide3034-34-243 % similar 4-Cyanophenyl isocyanate40465-45-043 % similar 4-Aminobenzonitrile873-74-541 % similar

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

Same formula

Hydralazine hydrochloride304-20-1

Elsewhere

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