chempirical

2-(Chloromethyl)-4,5-dihydro-1H-imidazole hydrochloride

C4H8Cl2N2CAS 13338-49-3155.02 g/mol

Open in Covalent MOL file
NHNClHCl
Alkyl halideAmidine

Properties

Molecular formula
C4H8Cl2N2
Molar mass
155.02 g/mol
Exact mass
154.0065 Da
logP
0.65Crippen estimate
Polar surface area
24.4 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1

Identifiers

CAS number
13338-49-3
SMILES
C1CN=C(N1)CCl.Cl
InChIKey
GHCCHMFFNHOXEU-UHFFFAOYSA-N
InChI
InChI=1S/C4H7ClN2.ClH/c5-3-4-6-1-2-7-4;/h1-3H2,(H,6,7);1H

Weigh it out

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

Work with 2-(Chloromethyl)-4,5-dihydro-1H-imidazole 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

Tolazoline hydrochloride59-97-247 % similar Antazoline hydrochloride2508-72-741 % similar Naphazoline hydrochloride550-99-240 % similar 2,2′-Azobis[2-(2-imidazolin-2-yl)propane] dihydrochloride27776-21-238 % similar Tolazoline59-98-338 % similar Xylometazoline hydrochloride1218-35-537 % similar Clonidine hydrochloride4205-91-836 % similar 2-Imidazolidinone120-93-436 % similar

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

Elsewhere

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