Cas no 913830-33-8 (4-Methylhomopiperazine-4-aminobenzene trihydrochloride monohydrate)

4-Methylhomopiperazine-4-aminobenzene trihydrochloride monohydrate structure
913830-33-8 structure
Product Name:4-Methylhomopiperazine-4-aminobenzene trihydrochloride monohydrate
CAS No:913830-33-8
MF:C12H24Cl3N3O
MW:332.697460174561
CID:802830
PubChem ID:44119580
Update Time:2025-04-19

4-Methylhomopiperazine-4-aminobenzene trihydrochloride monohydrate Chemical and Physical Properties

Names and Identifiers

    • 4-Methylhomopiperazine-4-aminobenzene trihydrochloride monohydrate
    • 4-(4-Methyl-1,4-diazepan-1-yl)aniline trihydrochloride hydrate
    • 4-(4-methyl-1,4-diazepan-1-yl)aniline,hydrate,trihydrochloride
    • 4-(4-METHYLHOMOPIPERAZIN-1-YL)ANILINE TRIHYDROCHLORIDE MONOHYDRATE
    • 1-(4-Aminophenyl)-4-methylhomopiperazine trihydrochloride hydrate
    • OR5215
    • 913830-33-8
    • 4-(4-methyl-1,4-diazepan-1-yl)aniline;hydrate;trihydrochloride
    • 4-(4-Methyl-1,4-diazepan-1-yl)aniline--hydrogen chloride--water (1/3/1)
    • DTXSID70657303
    • Inchi: 1S/C12H19N3.3ClH.H2O/c1-14-7-2-8-15(10-9-14)12-5-3-11(13)4-6-12;;;;/h3-6H,2,7-10,13H2,1H3;3*1H;1H2
    • InChI Key: RSGOMRQTIZQMIR-UHFFFAOYSA-N
    • SMILES: Cl.Cl.Cl.O.N1(C2C=CC(=CC=2)N)CCN(C)CCC1

Computed Properties

  • Exact Mass: 331.09800
  • Monoisotopic Mass: 331.098
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 5
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 1
  • Complexity: 187
  • Covalently-Bonded Unit Count: 5
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 33.5A^2

Experimental Properties

  • Melting Point: 238-250
  • Boiling Point: 510.7 °C at 760 mmHg
  • Flash Point: 262.7 °C
  • PSA: 41.73000
  • LogP: 4.33650

4-Methylhomopiperazine-4-aminobenzene trihydrochloride monohydrate Security Information

4-Methylhomopiperazine-4-aminobenzene trihydrochloride monohydrate Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Apollo Scientific
OR5215-250mg
4-(4-Methylhomopiperazin-1-yl)aniline trihydrochloride hydrate
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£75.00 2024-05-26
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SHANG HAI HAO HONG Biomedical Technology Co., Ltd.
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SHANG HAI HAO HONG Biomedical Technology Co., Ltd.
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