Cas no 34440-94-3 (N-chrysen-4-ylformamide)
N-chrysen-4-ylformamide structure
Product Name:N-chrysen-4-ylformamide
CAS No:34440-94-3
MF:C19H13NO
MW:271.312624692917
CID:919181
PubChem ID:296539
Update Time:2025-04-19
N-chrysen-4-ylformamide Chemical and Physical Properties
Names and Identifiers
-
- N-chrysen-4-ylformamide
- DTXSID80304659
- 34440-94-3
- NSC166743
- NSC-166743
-
- Inchi: 1S/C19H13NO/c21-12-20-18-7-3-5-14-9-10-16-15-6-2-1-4-13(15)8-11-17(16)19(14)18/h1-12H,(H,20,21)
- InChI Key: ZJBLBCSANAZBKE-UHFFFAOYSA-N
- SMILES: O=CNC1=CC=CC2=CC=C3C4C=CC=CC=4C=CC3=C21
Computed Properties
- Exact Mass: 271.09979
- Monoisotopic Mass: 271.1
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 21
- Rotatable Bond Count: 1
- Complexity: 382
- 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: 4.9
- Topological Polar Surface Area: 29.1?2
Experimental Properties
- Density: 1.3
- Boiling Point: 569.3°C at 760 mmHg
- Flash Point: 338.9°C
- Refractive Index: 1.805
- PSA: 29.1
N-chrysen-4-ylformamide 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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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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