Cas no 61152-06-5 (4-Oxazolecarbonyl chloride, 2-(4-fluorophenyl)-5-methyl-)
61152-06-5 structure
Product Name:4-Oxazolecarbonyl chloride, 2-(4-fluorophenyl)-5-methyl-
CAS No:61152-06-5
MF:C11H7ClFNO2
MW:239.630185365677
CID:490430
PubChem ID:12282204
Update Time:2025-04-19
4-Oxazolecarbonyl chloride, 2-(4-fluorophenyl)-5-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 4-Oxazolecarbonyl chloride, 2-(4-fluorophenyl)-5-methyl-
- 2-(4-fluorophenyl)-5-methyl-1,3-oxazole-4-carbonyl chloride
- DTXSID90484077
- 61152-06-5
- 2-(4-Fluorophenyl)-5-methyloxazole-4-carbonyl chloride
-
- Inchi： 1S/C11H7ClFNO2/c1-6-9(10(12)15)14-11(16-6)7-2-4-8(13)5-3-7/h2-5H,1H3
- InChI Key： OVMGFJQPSQGJMS-UHFFFAOYSA-N
- SMILES： ClC(C1=C(C)OC(C2C=CC(=CC=2)F)=N1)=O
Computed Properties
- Exact Mass: 239.01501
- Monoisotopic Mass: 239.0149343g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 269
- 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: 43.1?2
Experimental Properties
- PSA: 43.1
4-Oxazolecarbonyl chloride, 2-(4-fluorophenyl)-5-methyl- Related Literature
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Martin R. Ward,Gary W. Copeland,Andrew J. Alexander Chem. Commun., 2010,46, 7634-7636
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
-
Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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