Cas no 50327-77-0 (butane-1,4-diamine; hexanedioic acid)
50327-77-0 structure
Product Name:butane-1,4-diamine; hexanedioic acid
CAS No:50327-77-0
MF:C10H22N2O4
MW:234.292683124542
CID:372111
PubChem ID:6452194
Update Time:2025-04-19
butane-1,4-diamine; hexanedioic acid Chemical and Physical Properties
Names and Identifiers
-
- butane-1,4-diamine,hexanedioic acid
- HEXANEDIOICACIDPOLYMERWITH1,4-DIBUTANEDIAMINE
- butane-1,4-diamine
- hexanedioic acid
- Hexanedioic acid polymer with 1,4-butanediamine
- POLYAMIDE 4
- Polyamide 46
- DTXSID30964606
- 1,4-Butanediamine, hexanedioate (1:1)
- Q27270775
- Adipic acid 1,4-butanediamine salt
- Adipic acid tetramethylenediamine salt
- UNII-8N4WWW5620
- 50327-77-0
- SCHEMBL2537893
- NS00129026
- 52384-54-0
- 1,4-Butanediamine adipate
- Nylon 46 salt
- 8N4WWW5620
- Putrescine, adipate
- Hexanedioic acid--butane-1,4-diamine (1/1)
- butane-1,4-diamine; hexanedioic acid
-
- Inchi： 1S/C6H10O4.C4H12N2/c7-5(8)3-1-2-4-6(9)10;5-3-1-2-4-6/h1-4H2,(H,7,8)(H,9,10);1-6H2
- InChI Key： SHPVGWLRFPFLNE-UHFFFAOYSA-N
- SMILES： OC(CCCCC(=O)O)=O.NCCCCN
Computed Properties
- Exact Mass: 234.15806
- Monoisotopic Mass: 234.157957
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 16
- Rotatable Bond Count: 8
- Complexity: 131
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: nothing
- Topological Polar Surface Area: 127
Experimental Properties
- PSA: 126.64
butane-1,4-diamine; hexanedioic acid Related Literature
-
Marta Liras,Isabel Quijada-Garrido,Marta Palacios-Cuesta,Sonia Mu?oz-Durieux,Olga García Polym. Chem., 2014,5, 433-442
-
Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
-
Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
-
Eunice Y.-L. Hui,Bhimsen Rout,Yaw Sing Tan,Kok-Ping Chan,Charles W. Johannes Org. Biomol. Chem., 2018,16, 389-392
50327-77-0 (butane-1,4-diamine; hexanedioic acid) Related Products
- 660-88-8(5-Aminovaleric Acid)
- 1120-12-3(9-Aminononanoic acid)
- 32131-17-2(Nylon 6/6)
- 60-32-2(6-Aminocaproic acid)
- 693-57-2(12-Aminolauric Acid)
- 1002-57-9(8-Aminooctanoic acid)
- 13108-19-5(10-Aminodecanoic Acid)
- 56-12-2(γ-Aminobutyric acid)
- 2432-99-7(11-Aminoundecanoic acid)
- 929-17-9(7-Aminoheptanoic acid)
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