Cas no 183270-47-5 (Benzoic acid, 3-(3-aminophenoxy)-, methyl ester)
183270-47-5 structure
Product Name:Benzoic acid, 3-(3-aminophenoxy)-, methyl ester
CAS No:183270-47-5
MF:C14H13NO3
MW:243.257923841476
CID:1377107
PubChem ID:19707463
Update Time:2025-04-20
Benzoic acid, 3-(3-aminophenoxy)-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid, 3-(3-aminophenoxy)-, methyl ester
- methyl 3-(3-aminophenoxy)benzoate
- DA-08991
- DTXSID30599371
- 3-[(3-carbomethoxyphenyl)oxy]-aminobenzene
- KMNZDPFPFDVSKG-UHFFFAOYSA-N
- SCHEMBL8367495
- F78373
- 183270-47-5
-
- Inchi： 1S/C14H13NO3/c1-17-14(16)10-4-2-6-12(8-10)18-13-7-3-5-11(15)9-13/h2-9H,15H2,1H3
- InChI Key： KMNZDPFPFDVSKG-UHFFFAOYSA-N
- SMILES： O(C1C=CC=C(C=1)N)C1=CC=CC(C(=O)OC)=C1
Computed Properties
- Exact Mass: 243.08959
- Monoisotopic Mass: 243.08954328g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 18
- Rotatable Bond Count: 4
- Complexity: 282
- 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: 2.6
- Topological Polar Surface Area: 61.6?2
Experimental Properties
- PSA: 61.55
Benzoic acid, 3-(3-aminophenoxy)-, methyl ester Related Literature
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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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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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
183270-47-5 (Benzoic acid, 3-(3-aminophenoxy)-, methyl ester) Related Products
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- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
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- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
- 89640-58-4(2-Iodo-4-nitrophenylhydrazine)
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