Cas no 80378-50-3 (1,3-Butanediamine, N,N'-diphenyl-)
80378-50-3 structure
Product Name:1,3-Butanediamine, N,N'-diphenyl-
CAS No:80378-50-3
MF:C16H20N2
MW:240.343403816223
CID:705767
PubChem ID:12726509
Update Time:2025-04-19
1,3-Butanediamine, N,N'-diphenyl- Chemical and Physical Properties
Names and Identifiers
-
- 1,3-Butanediamine, N,N'-diphenyl-
- 1-N,3-N-diphenylbutane-1,3-diamine
- 80378-50-3
- SCHEMBL1454227
- DTXSID40508191
- N~1~,N~3~-Diphenylbutane-1,3-diamine
-
- Inchi： 1S/C16H20N2/c1-14(18-16-10-6-3-7-11-16)12-13-17-15-8-4-2-5-9-15/h2-11,14,17-18H,12-13H2,1H3
- InChI Key： IWVFBPWHTLNIJK-UHFFFAOYSA-N
- SMILES： N(C1C=CC=CC=1)C(C)CCNC1C=CC=CC=1
Computed Properties
- Exact Mass: 240.162648646g/mol
- Monoisotopic Mass: 240.162648646g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 18
- Rotatable Bond Count: 6
- Complexity: 205
- 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: 4.4
- Topological Polar Surface Area: 24.1?2
1,3-Butanediamine, N,N'-diphenyl- Related Literature
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Eunkyung Choi,Minjoo Ryu,Haeri Lee,Ok-Sang Jung Dalton Trans., 2017,46, 4595-4601
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Lianqin Wang,Rachida Bance-Soualhi,Julia Ponce-González,Pilar Ocón,Edson A. Ticianelli,Daniel K. Whelligan,John R. Varcoe J. Mater. Chem. A, 2018,6, 24330-24341
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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