Cas no 61485-95-8 (Benzoyl chloride, 2-(4-methylphenoxy)-)
61485-95-8 structure
Product Name:Benzoyl chloride, 2-(4-methylphenoxy)-
CAS No:61485-95-8
MF:C14H11ClO2
MW:246.688943147659
CID:477641
PubChem ID:71395383
Update Time:2025-04-19
Benzoyl chloride, 2-(4-methylphenoxy)- Chemical and Physical Properties
Names and Identifiers
-
- Benzoyl chloride, 2-(4-methylphenoxy)-
- 2-(4-methylphenoxy)benzoyl chloride
- DTXSID80817012
- 61485-95-8
-
- Inchi： 1S/C14H11ClO2/c1-10-6-8-11(9-7-10)17-13-5-3-2-4-12(13)14(15)16/h2-9H,1H3
- InChI Key： JQEWRYLVHPLJQQ-UHFFFAOYSA-N
- SMILES： ClC(C1C=CC=CC=1OC1C=CC(C)=CC=1)=O
Computed Properties
- Exact Mass: 246.04483
- Monoisotopic Mass: 246.0447573g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 17
- Rotatable Bond Count: 3
- Complexity: 259
- 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: 4.5
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- PSA: 26.3
Benzoyl chloride, 2-(4-methylphenoxy)- Related Literature
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
61485-95-8 (Benzoyl chloride, 2-(4-methylphenoxy)-) Related Products
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