Cas no 56183-24-5 (5,6-Chrysenediol,5,6-dihydro-, (5R,6R)-rel-)
56183-24-5 structure
Product Name:5,6-Chrysenediol,5,6-dihydro-, (5R,6R)-rel-
CAS No:56183-24-5
MF:C18H14O2
MW:262.302565097809
CID:371020
PubChem ID:41776
Update Time:2025-04-19
5,6-Chrysenediol,5,6-dihydro-, (5R,6R)-rel- Chemical and Physical Properties
Names and Identifiers
-
- (5R,6R)-5,6-dihydrochrysene-5,6-diol
- 5,6-Chrysenediol,5,6-dihydro-, (5R,6R)-rel-
- CHRYSENE-TRANS-5,6-DIHYDRODIOL
- Chrysene-trans-5,6-dihydrodiolneat
- CHRYSENE-5,6-DIOL,5,6-DIHYDRO-,trans
- trans-5,6-Dihydro-5,6-dihydroxychrysene
- trans-5,6-Dihydrochrysene-5,6-diol
- trans-5,6-Dihydroxy-5,6-dihydrochrysene
- trans-Chrysene-5,6-diol
- CHRYSENE-5,6-DIOL, 5,6-DIHYDRO-, trans-
- 56183-24-5
- CCRIS 2021
- DTXSID60204729
-
- Inchi: 1S/C18H14O2/c19-17-15-8-4-3-7-13(15)14-10-9-11-5-1-2-6-12(11)16(14)18(17)20/h1-10,17-20H/t17-,18-/m1/s1
- InChI Key: LMNSFGGRBHRGSN-QZTJIDSGSA-N
- SMILES: O[C@H]1[C@@H](C2C=CC=CC=2C2C=CC3C=CC=CC=3C1=2)O
Computed Properties
- Exact Mass: 262.09900
- Monoisotopic Mass: 262.099
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 20
- Rotatable Bond Count: 0
- Complexity: 355
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.9
- Topological Polar Surface Area: 40.5A^2
Experimental Properties
- Density: 1.35
- Boiling Point: 497.7°Cat760mmHg
- Flash Point: 242.7°C
- Refractive Index: 1.754
- PSA: 40.46000
- LogP: 3.58720
5,6-Chrysenediol,5,6-dihydro-, (5R,6R)-rel- Related Literature
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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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
-
Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
-
Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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