Cas no 88916-61-4 (2-(phenanthren-4-yl)ethanol)
2-(phenanthren-4-yl)ethanol structure
Product Name:2-(phenanthren-4-yl)ethanol
CAS No:88916-61-4
MF:C16H14O
MW:222.281764507294
CID:993482
PubChem ID:263268
Update Time:2025-04-20
2-(phenanthren-4-yl)ethanol Chemical and Physical Properties
Names and Identifiers
-
- 2-(phenanthren-4-yl)ethanol
- 2-phenanthren-4-ylethanol
- NSC97652
- NSC-97652
- 88916-61-4
- 4-Phenanthreneethanol
- DTXSID70294691
-
- Inchi: 1S/C16H14O/c17-11-10-14-6-3-5-13-9-8-12-4-1-2-7-15(12)16(13)14/h1-9,17H,10-11H2
- InChI Key: RFAVOBZDPQHPGU-UHFFFAOYSA-N
- SMILES: OCCC1C=CC=C2C=CC3C=CC=CC=3C=12
Computed Properties
- Exact Mass: 222.104
- Monoisotopic Mass: 222.104
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 17
- Rotatable Bond Count: 2
- Complexity: 250
- 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
- Topological Polar Surface Area: 20.2?2
Experimental Properties
- Density: 1.182
- Boiling Point: 425.6°C at 760 mmHg
- Flash Point: 190.9°C
- Refractive Index: 1.704
- PSA: 20.23000
- LogP: 3.52780
2-(phenanthren-4-yl)ethanol Related Literature
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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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
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