Cas no 88730-69-2 (Carbonic acid, (4-methylphenyl)methyl phenylmethyl ester)
88730-69-2 structure
Product Name:Carbonic acid, (4-methylphenyl)methyl phenylmethyl ester
CAS No:88730-69-2
MF:C16H16O3
MW:256.296444892883
CID:622878
PubChem ID:10131302
Update Time:2025-04-19
Carbonic acid, (4-methylphenyl)methyl phenylmethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Carbonic acid, (4-methylphenyl)methyl phenylmethyl ester
- benzyl (4-methylphenyl)methyl carbonate
- DTXSID80436065
- 88730-69-2
- SCHEMBL6647983
-
- Inchi： 1S/C16H16O3/c1-13-7-9-15(10-8-13)12-19-16(17)18-11-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3
- InChI Key： QIXAWILBAIGNFQ-UHFFFAOYSA-N
- SMILES： O(C(=O)OCC1C=CC=CC=1)CC1C=CC(C)=CC=1
Computed Properties
- Exact Mass: 256.109944368g/mol
- Monoisotopic Mass: 256.109944368g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 19
- Rotatable Bond Count: 6
- Complexity: 263
- 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: 3.9
- Topological Polar Surface Area: 35.5?2
Carbonic acid, (4-methylphenyl)methyl phenylmethyl ester Related Literature
-
Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
-
Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
-
Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
-
H. V. Jain,D. Verthelyi,S. L. Beaucage RSC Adv., 2017,7, 42519-42528
88730-69-2 (Carbonic acid, (4-methylphenyl)methyl phenylmethyl ester) Related Products
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