Cas no 115880-50-7 (Propanoic acid, 2-phenoxy-, methyl ester, (R)-)
115880-50-7 structure
Product Name:Propanoic acid, 2-phenoxy-, methyl ester, (R)-
CAS No:115880-50-7
MF:C10H12O3
MW:180.200483322144
CID:1204970
PubChem ID:736878
Update Time:2025-04-20
Propanoic acid, 2-phenoxy-, methyl ester, (R)- Chemical and Physical Properties
Names and Identifiers
-
- Propanoic acid, 2-phenoxy-, methyl ester, (R)-
- (R)-2-phenoxypropanoic acid methyl ester
- Methyl (R)-2-phenoxypropionate
- KIBRBMKSBVQDMK-MRVPVSSYSA-N
- Methyl (R)-2-phenoxypropanoate
- 115880-50-7
- Methyl(R)-2-phenoxypropionate
- (r)-2-phenoxypropionic acid methyl ester
-
- Inchi： 1S/C10H12O3/c1-8(10(11)12-2)13-9-6-4-3-5-7-9/h3-8H,1-2H3/t8-/m1/s1
- InChI Key： KIBRBMKSBVQDMK-MRVPVSSYSA-N
- SMILES： O(C1C=CC=CC=1)[C@@H](C(=O)OC)C
Computed Properties
- Exact Mass: 180.078644241g/mol
- Monoisotopic Mass: 180.078644241g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 4
- Complexity: 162
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.2
- Topological Polar Surface Area: 35.5?2
Experimental Properties
- PSA: 35.53000
- LogP: 1.62690
Propanoic acid, 2-phenoxy-, methyl ester, (R)- Related Literature
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
-
Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
-
Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
115880-50-7 (Propanoic acid, 2-phenoxy-, methyl ester, (R)-) Related Products
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- 1129-46-0((R)-2-Phenoxypropionic Acid)
- 940-31-8(2-phenoxypropanoic acid)
- 150436-68-3(Lactisole)
- 2065-24-9(Methyl 2-Phenoxypropanoate)
- 67648-61-7(2-(4-Hydroxyphenoxy)propanoic acid)
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- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
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