Cas no 126289-14-3 (1,5-Pentanediamine, methyl-)
1,5-Pentanediamine, methyl- structure
Product Name:1,5-Pentanediamine, methyl-
CAS No:126289-14-3
MF:C6H16N2
MW:116.204641342163
CID:1223437
PubChem ID:11007871
Update Time:2025-04-20
1,5-Pentanediamine, methyl- Chemical and Physical Properties
Names and Identifiers
-
- 1,5-Pentanediamine, methyl-
- hexane-1,5-diamine
- 1,5-Hexanediamine
- 5261-58-5
- SCHEMBL34359
- AKOS006340776
- EN300-213739
- DTXSID60451559
- 1,5-diaminohexane
- A819309
- 126289-14-3
-
- Inchi： 1S/C6H16N2/c1-6(8)4-2-3-5-7/h6H,2-5,7-8H2,1H3
- InChI Key： XTBMQKZEIICCCS-UHFFFAOYSA-N
- SMILES： NC(C)CCCCN
Computed Properties
- Exact Mass: 116.13148
- Monoisotopic Mass: 116.131348519g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 8
- Rotatable Bond Count: 4
- Complexity: 45.8
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -0.2
- Topological Polar Surface Area: 52?2
Experimental Properties
- PSA: 52.04
1,5-Pentanediamine, methyl- Related Literature
-
Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
-
Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
-
Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
126289-14-3 (1,5-Pentanediamine, methyl-) Related Products
- 693-16-3(octan-2-amine)
- 63493-28-7(pentan-2-amine)
- 5452-35-7(cycloheptanamine)
- 3114-70-3(Cyclohexane-1,4-diamine)
- 5329-79-3(1-Methylpentylamine)
- 5452-37-9(Cyclooctylamine)
- 616-24-0(3-Aminopentane)
- 2615-25-0(trans-cyclohexane-1,4-diamine)
- 6240-90-0((R)-(?)-2-Aminoheptane)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
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