Cas no 16053-79-5 (Benz[a]anthracen-3-ol,12-methyl-)
![Benz[a]anthracen-3-ol,12-methyl- structure](https://ossimg.kuujia.com/scimg/16500/16053-79-5x500.png)
16053-79-5 structure
Product Name:Benz[a]anthracen-3-ol,12-methyl-
CAS No:16053-79-5
MF:C19H14O
MW:258.313865184784
CID:216812
PubChem ID:13972339
Update Time:2025-04-19
Benz[a]anthracen-3-ol,12-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Benz[a]anthracen-3-ol,12-methyl-
- 12-methylbenzo[a]anthracen-3-ol
- 16053-79-5
- DTXSID40936339
- Benz(a)anthracen-3-ol, 12-methyl-
- 12-METHYLTETRAPHEN-3-OL
- 12-Methylbenz(a)anthracen-3-ol
-
- Inchi： 1S/C19H14O/c1-12-17-5-3-2-4-13(17)10-15-7-6-14-11-16(20)8-9-18(14)19(12)15/h2-11,20H,1H3
- InChI Key： NDQOBONPTUTUSI-UHFFFAOYSA-N
- SMILES： OC1C=CC2=C(C=1)C=CC1=CC3C=CC=CC=3C(C)=C12
Computed Properties
- Exact Mass: 258.10452
- Monoisotopic Mass: 258.104465066g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 20
- Rotatable Bond Count: 0
- Complexity: 352
- 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: 5.7
- Topological Polar Surface Area: 20.2?2
Experimental Properties
- PSA: 20.23
Benz[a]anthracen-3-ol,12-methyl- Related Literature
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
-
Andre Prates Pereira,Tao Dong,Eric P. Knoshaug,Nick Nagle,Ryan Spiller,Bonnie Panczak,Christopher J. Chuck,Philip T. Pienkos Sustainable Energy Fuels, 2020,4, 3400-3408
-
Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
-
Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
-
Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
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