Cas no 71136-43-1 (7,12-bis(hydroxymethyl)tetraphen-2-ol)
71136-43-1 structure
Product Name:7,12-bis(hydroxymethyl)tetraphen-2-ol
CAS No:71136-43-1
MF:C20H16O3
MW:304.339245796204
CID:1748130
PubChem ID:153194
Update Time:2025-04-21
7,12-bis(hydroxymethyl)tetraphen-2-ol Chemical and Physical Properties
Names and Identifiers
-
- 7,12-bis(hydroxymethyl)tetraphen-2-ol
- 2-Hydroxybenz(a)anthracene-7,12-dimethanol
- Benz(a)anthracene-7,12-dimethanol, 2-hydroxy-
- 7,12-bis(hydroxymethyl)benzo[a]anthracen-2-ol
- DTXSID60221335
- 71136-43-1
-
- Inchi： 1S/C20H16O3/c21-10-18-14-3-1-2-4-15(14)19(11-22)20-16(18)8-6-12-5-7-13(23)9-17(12)20/h1-9,21-23H,10-11H2
- InChI Key： JWQMNDANRQMRPI-UHFFFAOYSA-N
- SMILES： OCC1C2C=CC=CC=2C(CO)=C2C=CC3C=CC(=CC=3C2=1)O
Computed Properties
- Exact Mass: 304.10998
- Monoisotopic Mass: 304.109944368g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 23
- Rotatable Bond Count: 2
- Complexity: 412
- 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: 2.9
- Topological Polar Surface Area: 60.7?2
Experimental Properties
- PSA: 60.69
7,12-bis(hydroxymethyl)tetraphen-2-ol Related Literature
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
-
Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
-
Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
-
Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
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