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913830-33-8

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Basic Information
CAS No.: 913830-33-8
Name: 4-Methylhomopiperazine-4-aminobenzene trihydrochloride monohydrate
Molecular Structure:
Molecular Structure of 913830-33-8 (4-Methylhomopiperazine-4-aminobenzene trihydrochloride monohydrate)
Formula: C12H24Cl3N3O
Molecular Weight: 332.6975
Synonyms: Benzenamine, 4-(hexahydro-4-methyl-1H-1,4-diazepin-1-yl)-, trihydrochloride, monohydrate (9CI);Benzenamine, 4-(hexahydro-4-methyl-1H-1,4-diazepin-1-yl)-,hydrochloride, hydrate (1:3:1);4-(4-Methylhomopiperazin-1-yl)aniline trihydrochloride monohydrate;
Melting Point: 238-250 °C
Boiling Point: 510.7 °C at 760 mmHg
Flash Point: 262.7 °C
PSA: 41.73000
LogP: 4.33650
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  • 4-Methylhomopiperazine-4-aminobenzene trihydrochloride monohydrate

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    913830-33-8

    4-Methylhomopiperazine-4-aminobenzene trihydrochloride monohydrate

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  • 4-(4-Methyl-1,4-diazepan-1-yl)aniline trihydrochloride hydrate

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    4-(4-Methyl-1,4-diazepan-1-yl)aniline trihydrochloride hydrate

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  • 4-(4-METHYLHOMOPIPERAZIN-1-YL)ANILINE TRI HCLMONOHYDRATE

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    913830-33-8

    4-(4-METHYLHOMOPIPERAZIN-1-YL)ANILINE TRI HCLMONOHYDRATE

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    4-(4-METHYLHOMOPIPERAZIN-1-YL)ANILINE TRI HCLMONOHYDRATEAppearance:white crystalline powder Storage:Store in dry, dark and ventilated place Package:25KG drum Application:intermediate Transportation:by air, by sea, by express

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Chemistry

Molecular Structure of 4-Methylhomopiperazine-4-aminobenzene trihydrochloride monohydrate (CAS NO.913830-33-8):

Systematic Name: 4-(4-Methyl-1,4-diazepan-1-yl)aniline hydrate trihydrochloride
SMILES: CN1CCCN(CC1)c2ccc(cc2)N.O.Cl.Cl.Cl
InChI: InChI=1/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
InChIKey: RSGOMRQTIZQMIR-UHFFFAOYAG 
Empirical Formula: C12H24Cl3N3O
Molecular Weight: 332.6975
Nominal Mass: 331 Da
Average Mass: 332.6975 Da
Monoisotopic Mass: 331.098496 Da 
H bond acceptors: 4
H bond donors: 4
Freely Rotating Bonds: 2
Flash Point: 262.7 °C
Enthalpy of Vaporization: 82.29 kJ/mol
Boiling Point: 510.7 °C at 760 mmHg
Vapour Pressure: 2.96E-11 mmHg at 25 °C
Melting Point: 238-250 °C

Safety Profile

Safety Information of 4-Methylhomopiperazine-4-aminobenzene trihydrochloride monohydrate (CAS NO.913830-33-8):
Hazard Note: Harmful

Specification

  4-Methylhomopiperazine-4-aminobenzene trihydrochloride monohydrate (CAS NO.913830-33-8), its Synonyms are Benzenamine, 4-(hexahydro-4-methyl-1H-1,4-diazepin-1-yl)-,hydrochloride, hydrate (1:3:1) ; Benzenamine, 4-(hexahydro-4-methyl-1H-1,4-diazepin-1-yl)-, trihydrochloride, monohydrate (9CI) ; 4-(4-Methylhomopiperazin-1-yl)aniline trihydrochloride monohydrate .