Cas no 121324-51-4 (Benzenecarboximidamide,3,3'-[1,6-hexanediylbis(oxy)]bis-)
![Benzenecarboximidamide,3,3'-[1,6-hexanediylbis(oxy)]bis- structure](https://ossimg.kuujia.com/scimg/121500/121324-51-4x500.png)
121324-51-4 structure
Product Name:Benzenecarboximidamide,3,3'-[1,6-hexanediylbis(oxy)]bis-
CAS No:121324-51-4
MF:C20H26N4O2
MW:354.446044445038
CID:181366
PubChem ID:147656
Update Time:2025-04-19
Benzenecarboximidamide,3,3'-[1,6-hexanediylbis(oxy)]bis- Chemical and Physical Properties
Names and Identifiers
-
- Benzenecarboximidamide,3,3'-[1,6-hexanediylbis(oxy)]bis-
- 3-[6-(3-carbamimidoylphenoxy)hexoxy]benzenecarboximidamide
- 1,6-Di(3-amidinophenoxy)hexane
- 3,3'-(1,6-Hexanediylbis(oxy))bis-benzenecarboximidamide
- 3-[6-(3-carbamimidoylphenoxy)hexoxy]benzamidine
- CHEMBL22947
- DTXSID60153228
- 121324-51-4
-
- Inchi： 1S/C20H26N4O2/c21-19(22)15-7-5-9-17(13-15)25-11-3-1-2-4-12-26-18-10-6-8-16(14-18)20(23)24/h5-10,13-14H,1-4,11-12H2,(H3,21,22)(H3,23,24)
- InChI Key： VHMMXGSRKCGGJH-UHFFFAOYSA-N
- SMILES： O(C1C=CC=C(C(=N)N)C=1)CCCCCCOC1C=CC=C(C(=N)N)C=1
Computed Properties
- Exact Mass: 354.20578
- Monoisotopic Mass: 354.205576
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 26
- Rotatable Bond Count: 11
- Complexity: 404
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 118
- XLogP3: 2.9
Experimental Properties
- Density: 1.19
- Boiling Point: 554.2°Cat760mmHg
- Flash Point: 289°C
- Refractive Index: 1.587
- PSA: 118.2
Benzenecarboximidamide,3,3'-[1,6-hexanediylbis(oxy)]bis- Related Literature
-
Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
-
Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
-
Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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