Cas no 22421-85-8 (Phosphoric triamide, hexabutyl-)
22421-85-8 structure
Product Name:Phosphoric triamide, hexabutyl-
CAS No:22421-85-8
MF:C24H54N3OP
MW:431.678827762604
CID:238732
PubChem ID:13378731
Update Time:2025-04-19
Phosphoric triamide, hexabutyl- Chemical and Physical Properties
Names and Identifiers
-
- Phosphoric triamide, hexabutyl-
- N-bis(dibutylamino)phosphoryl-N-butylbutan-1-amine
- N,N,N',N',N'',N''-Hexabutylphosphoric triamide
- phosphoric acid tris-(dibutylamide)
- CQKIJHDQEAQSSZ-UHFFFAOYSA-N
- DTXSID10538748
- SCHEMBL9246188
- 22421-85-8
- hexabutyltriamidophosphate
-
- Inchi: 1S/C24H54N3OP/c1-7-13-19-25(20-14-8-2)29(28,26(21-15-9-3)22-16-10-4)27(23-17-11-5)24-18-12-6/h7-24H2,1-6H3
- InChI Key: CQKIJHDQEAQSSZ-UHFFFAOYSA-N
- SMILES: P(N(CCCC)CCCC)(N(CCCC)CCCC)(N(CCCC)CCCC)=O
Computed Properties
- Exact Mass: 431.40082
- Monoisotopic Mass: 431.40045035g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 29
- Rotatable Bond Count: 21
- Complexity: 325
- 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
- XLogP3: 7.6
- Topological Polar Surface Area: 26.8?2
Experimental Properties
- PSA: 26.79
Phosphoric triamide, hexabutyl- Related Literature
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
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Daniel Messmer,Stefan Salentinig,Jakob Heier Nanoscale, 2019,11, 6929-6938
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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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