Cas no 123358-44-1 (benzo[pqr]tetraphen-4-ylmethanido)
123358-44-1 structure
Product Name:benzo[pqr]tetraphen-4-ylmethanido
CAS No:123358-44-1
MF:C21H13
MW:265.327925443649
CID:1218256
PubChem ID:56841056
Update Time:2025-04-20
benzo[pqr]tetraphen-4-ylmethanido Chemical and Physical Properties
Names and Identifiers
-
- benzo[pqr]tetraphen-4-ylmethanido
- Methylium, benzo[a]pyren-4-yl-
-
- Inchi: 1S/C21H13/c1-13-11-16-12-15-5-2-3-7-18(15)19-10-9-14-6-4-8-17(13)20(14)21(16)19/h2-12H,1H2/q+1
- InChI Key: OREHNTZEZDMEHL-UHFFFAOYSA-N
- SMILES: C12C3C=C([CH2+])C4=CC=CC(=CC=C1C1C=CC=CC=1C=3)C=24
Computed Properties
- Exact Mass: 265.10179
- Monoisotopic Mass: 265.101725
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 21
- Rotatable Bond Count: 0
- Complexity: 399
- 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: 0
- XLogP3: 6.6
Experimental Properties
- Boiling Point: 479.4°C at 760 mmHg
- Flash Point: 236.7°C
- PSA: 0
benzo[pqr]tetraphen-4-ylmethanido Related Literature
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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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