Molecular properties
- Formula
- C11H16ClN5
- Molar mass
- 253.74 g·mol−1
- Exact mass
- 253.1094 Da
- 6
- PubChem CID
- 6178111
Molecule record
(1E)-1-[amino-(4-chloroanilino)methylidene]-2-propan-2-ylguanidine
C11H16ClN5
253.74 g/mol
Loading structure
Functional groups
Alkane / alkyl carbon
Aromatic ring
Aryl halide
Primary amine
Secondary amine
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- 1-(p-Chlorophenyl)-5-isopropylbiguanide
- 207-915-6
- 500-92-5
- Bigumal
- CHEBI:8455
- Chlorguanid
- Chlorguanide
- Chloroguanide
Show all 24 synonyms
- DTXCID902794
- DTXSID3022794
- Imidodicarbonimidic diamide, N-(4-chlorophenyl)-N'-(1-methylethyl)-
- N-(4-Chlorophenyl)-N'-(isopropyl)-imidodicarbonimidic diamide
- N-(4-chlorophenyl)-N'-(propan-2-yl)imidodicarbonimidic diamide
- N1-(4-Chlorophenyl)-N5-isopropylbiguanide
- N1-p-Chlorophenyl-N5-isopropylbiguanide
- P01BB01
- Paludrin
- Proguanil (INN)
- Proguanile
- Proguanilum
- RefChem:176179
- S61K3P7B2V
- bigumalum (for the hydrochloride)
- proguanil
Structure identifiers
- Canonical SMILES
- CC(C)N=C(N)/N=C(\N)Nc1ccc(Cl)cc1
- Isomeric SMILES
- CC(C)N=C(N)/N=C(\N)/NC1=CC=C(C=C1)Cl
- InChI
- InChI=1S/C11H16ClN5/c1-7(2)15-10(13)17-11(14)16-9-5-3-8(12)4-6-9/h3-7H,1-2H3,(H5,13,14,15,16,17)
- InChIKey
- SSOLNOMRVKKSON-UHFFFAOYSA-N
- PubChem CID
- 6178111
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
No redistributable or simulated spectroscopy record is attached yet.
Simulated NMR
On-demand educational prediction for (1E)-1-[amino-(4-chloroanilino)methylidene]-2-propan-2-ylguanidine; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for (1E)-1-[amino-(4-chloroanilino)methylidene]-2-propan-2-ylguanidine; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.