Cas no 1614-30-8 (Thiourea,N,N''-[1,1'-biphenyl]-4,4'-diylbis-)
1614-30-8 structure
Product Name:Thiourea,N,N''-[1,1'-biphenyl]-4,4'-diylbis-
CAS No:1614-30-8
MF:C14H14N4S2
MW:302.417759418488
CID:213858
PubChem ID:3032409
Update Time:2025-04-19
Thiourea,N,N''-[1,1'-biphenyl]-4,4'-diylbis- Chemical and Physical Properties
Names and Identifiers
-
- Thiourea,N,N''-[1,1'-biphenyl]-4,4'-diylbis-
- [4-[4-(carbamothioylamino)phenyl]phenyl]thiourea
- p,p'-Biphenylene-bis-1,1'-(2-thiourea)
- 4,4'-Biphenylene bis(thiourea)
- AI3-24608
- BRN 2386663
- N,N''-biphenyl-4,4'-diylbis(thiourea)
- Thiourea, N,N''-(1,1'-biphenyl)-4,4'-diylbis-
- Urea, 1,1'-(4,4'-biphenylyene)bis(2-thio-
- 0-13-00-00229 (Beilstein Handbook Reference)
- DTXSID00167142
- p,p/'-Biphenylene-bis-1,1/'-(2-thiourea)
- 1614-30-8
-
- Inchi: 1S/C14H14N4S2/c15-13(19)17-11-5-1-9(2-6-11)10-3-7-12(8-4-10)18-14(16)20/h1-8H,(H3,15,17,19)(H3,16,18,20)
- InChI Key: FAOJSYHCXVRQKK-UHFFFAOYSA-N
- SMILES: S=C(N)NC1C=CC(=CC=1)C1C=CC(=CC=1)NC(N)=S
Computed Properties
- Exact Mass: 302.06622
- Monoisotopic Mass: 302.065988
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 20
- Rotatable Bond Count: 3
- Complexity: 311
- 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: 140
- XLogP3: 2
Experimental Properties
- Density: 1.433
- Boiling Point: 501.9°Cat760mmHg
- Flash Point: 257.3°C
- Refractive Index: 1.818
- PSA: 76.1
Thiourea,N,N''-[1,1'-biphenyl]-4,4'-diylbis- Related Literature
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
-
Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
-
Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
-
Daniel Messmer,Stefan Salentinig,Jakob Heier Nanoscale, 2019,11, 6929-6938
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