Cas no 147080-44-2 (Benzoic acid,4-(nonyloxy)-, methyl ester)
147080-44-2 structure
Product Name:Benzoic acid,4-(nonyloxy)-, methyl ester
CAS No:147080-44-2
MF:C17H26O3
MW:278.386545658112
CID:105278
PubChem ID:53435548
Update Time:2025-04-18
Benzoic acid,4-(nonyloxy)-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid,4-(nonyloxy)-, methyl ester
- METHYL 4-N-NONYLOXYBENZOATE
- methyl 4-nonoxybenzoate
- METHYL 4-NONYLOXYBENZOATE
- p-Nonyloxybenzoesaeuremethylester
- RARECHEM AL BF 1496
- METHYL P-NONYLOXYBENZOATE
- 4-n-Nonyloxybenzoic acid methyl ester
- FT-0628655
- OYWJJVYVAIBTQS-UHFFFAOYSA-N
- SCHEMBL21908583
- 147080-44-2
- DTXSID00700755
- AKOS009157670
- METHYL 4-(NONYLOXY)BENZOATE
-
- Inchi： 1S/C17H26O3/c1-3-4-5-6-7-8-9-14-20-16-12-10-15(11-13-16)17(18)19-2/h10-13H,3-9,14H2,1-2H3
- InChI Key： OYWJJVYVAIBTQS-UHFFFAOYSA-N
- SMILES： O(C1C=CC(C(=O)OC)=CC=1)CCCCCCCCC
Computed Properties
- Exact Mass: 278.18800
- Monoisotopic Mass: 278.18819469g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 20
- Rotatable Bond Count: 11
- Complexity: 245
- 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: 5.8
- Topological Polar Surface Area: 35.5?2
Experimental Properties
- PSA: 35.53000
- LogP: 4.60260
Benzoic acid,4-(nonyloxy)-, methyl ester Security Information
- Safety Instruction： S24/25
- Safety Term：S24/25
Benzoic acid,4-(nonyloxy)-, methyl ester 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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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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4. Estimation of hydrogen sulfide from crude petroleum: a unique invention using a simple chemosensor?Shampa Kundu,Prithidipa Sahoo New J. Chem., 2019,43, 12369-12374
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5. Estimating and correcting interference fringes in infrared spectra in infrared hyperspectral imagingGhazal Azarfar,Ebrahim Aboualizadeh,Nicholas M. Walter,Simona Ratti,Camilla Olivieri,Alessandra Norici,Michael Nasse,Achim Kohler,Mario Giordano Analyst, 2018,143, 4674-4683
147080-44-2 (Benzoic acid,4-(nonyloxy)-, methyl ester) Related Products
- 4906-25-6(Methyl 4-n-butoxybenzoate)
- 15872-43-2(4-(N-Nonyloxy)Benzoic Acid)
- 15872-44-3(4-Undecyloxybenzoic Acid)
- 62435-37-4(Methyl 4-n-octyloxybenzoate)
- 1498-96-0(4-Butoxybenzoic acid)
- 2493-84-7(4-N-Octyloxybenzoic Acid)
- 15872-41-0(4-N-Pentyloxybenzoic Acid)
- 1142-39-8(4-(Hexyloxy)benzoic Acid)
- 2312-15-4(4-(Dodecyloxy)benzoic acid)
- 15872-42-1(4-(Heptyloxy)benzoic Acid)
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