Cas no 113674-51-4 (benzyl 2-formylbenzoate)
benzyl 2-formylbenzoate structure
Product Name:benzyl 2-formylbenzoate
CAS No:113674-51-4
MF:C15H12O3
MW:240.253984451294
CID:2611338
PubChem ID:246096
Update Time:2025-04-21
benzyl 2-formylbenzoate Chemical and Physical Properties
Names and Identifiers
-
- benzyl 2-formylbenzoate
- DTXCID90240195
- SCHEMBL381019
- 2-Carbobenzoxybenzaldehyde
- OEWWFQYTNGODQM-UHFFFAOYSA-N
- 113674-51-4
- NSC-58683
- DTXSID90289049
- Benzoic acid, 2-formyl-, phenylmethyl ester
- NSC58683
-
- Inchi： 1S/C15H12O3/c16-10-13-8-4-5-9-14(13)15(17)18-11-12-6-2-1-3-7-12/h1-10H,11H2
- InChI Key： OEWWFQYTNGODQM-UHFFFAOYSA-N
- SMILES： O(C(C1C=CC=CC=1C=O)=O)CC1C=CC=CC=1
Computed Properties
- Exact Mass: 240.078644241Da
- Monoisotopic Mass: 240.078644241Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 18
- Rotatable Bond Count: 5
- Complexity: 281
- 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: 3.3
- Topological Polar Surface Area: 43.4?2
benzyl 2-formylbenzoate Related Literature
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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2. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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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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