Cas no 16331-58-1 (1-Pyrenecarbonyl chloride)
1-Pyrenecarbonyl chloride structure
Product Name:1-Pyrenecarbonyl chloride
CAS No:16331-58-1
MF:C17H9ClO
MW:264.705763578415
CID:1345123
PubChem ID:10683080
Update Time:2025-04-20
1-Pyrenecarbonyl chloride Chemical and Physical Properties
Names and Identifiers
-
- 1-Pyrenecarbonyl chloride
- pyrene-1-carbonyl chloride
- AKOS025131618
- SCHEMBL3036869
- DTXSID00443493
- 1-pyrenoyl chloride
- 16331-58-1
-
- Inchi： 1S/C17H9ClO/c18-17(19)14-9-7-12-5-4-10-2-1-3-11-6-8-13(14)16(12)15(10)11/h1-9H
- InChI Key： FNRNHFMKSCPBDA-UHFFFAOYSA-N
- SMILES： ClC(C1C=CC2=CC=C3C=CC=C4C=CC=1C2=C43)=O
Computed Properties
- Exact Mass: 264.03427
- Monoisotopic Mass: 264.0341926g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 19
- Rotatable Bond Count: 1
- Complexity: 380
- 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: 5.5
- Topological Polar Surface Area: 17.1?2
Experimental Properties
- PSA: 17.07
1-Pyrenecarbonyl chloride Related Literature
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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Raktani Bikshapathi,Sai Prathima Parvathaneni,Vaidya Jayathirtha Rao Green Chem., 2017,19, 4446-4450
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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Luke L. Lairson,Warren W. Wakarchuk Chem. Commun., 2007, 365-367
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