Cas no 31201-88-4 (Acetonitrile, (diphenylphosphino)-)
31201-88-4 structure
Product Name:Acetonitrile, (diphenylphosphino)-
CAS No:31201-88-4
MF:C14H12NP
MW:225.22554397583
CID:1445848
PubChem ID:11622701
Update Time:2025-04-20
Acetonitrile, (diphenylphosphino)- Chemical and Physical Properties
Names and Identifiers
-
- Acetonitrile, (diphenylphosphino)-
- 2-diphenylphosphanylacetonitrile
- 31201-88-4
- SCHEMBL17279465
- diphenylcyanomethylphosphine
- DTXSID60469598
-
- Inchi： 1S/C14H12NP/c15-11-12-16(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10H,12H2
- InChI Key： ITKPJSFXLGJKAP-UHFFFAOYSA-N
- SMILES： P(CC#N)(C1C=CC=CC=1)C1C=CC=CC=1
Computed Properties
- Exact Mass: 225.07086
- Monoisotopic Mass: 225.070736385g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 16
- Rotatable Bond Count: 3
- Complexity: 225
- 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: 2.8
- Topological Polar Surface Area: 23.8?2
Experimental Properties
- PSA: 23.79
Acetonitrile, (diphenylphosphino)- Related Literature
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
-
Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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5. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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