Cas no 14617-97-1 (Butanoic acid, 3-nitrophenyl ester)
14617-97-1 structure
Product Name:Butanoic acid, 3-nitrophenyl ester
CAS No:14617-97-1
MF:C10H11NO4
MW:209.198642969131
CID:1315821
PubChem ID:551246
Update Time:2025-04-20
Butanoic acid, 3-nitrophenyl ester Chemical and Physical Properties
Names and Identifiers
-
- Butanoic acid, 3-nitrophenyl ester
- (3-nitrophenyl) butanoate
- Butanoic acid m-nitrophenyl ester
- Butanoic acid 3-nitrophenyl ester
- 3-Nitrophenyl butyrate #
- DTXSID50338800
- 14617-97-1
- m-Nitrophenyl butyrate
- SCHEMBL4849025
- RANXQNXWSFGIES-UHFFFAOYSA-N
- Butyric acid, m-nitrophenyl ester
-
- Inchi： 1S/C10H11NO4/c1-2-4-10(12)15-9-6-3-5-8(7-9)11(13)14/h3,5-7H,2,4H2,1H3
- InChI Key： RANXQNXWSFGIES-UHFFFAOYSA-N
- SMILES： O(C1C=CC=C(C=1)[N+](=O)[O-])C(CCC)=O
Computed Properties
- Exact Mass: 209.06883
- Monoisotopic Mass: 209.06880783g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 4
- Complexity: 236
- 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: 72.1?2
Experimental Properties
- PSA: 69.44
Butanoic acid, 3-nitrophenyl ester Related Literature
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
-
Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
-
Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
-
5. An amorphous lanthanum–iridium solid solution with an open structure for efficient water splitting?Wei Sun,Chenglong Ma,Xinlong Tian,Jianjun Liao,Ji Yang,Chengjun Ge,Weiwei Huang J. Mater. Chem. A, 2020,8, 12518-12525
14617-97-1 (Butanoic acid, 3-nitrophenyl ester) Related Products
- 1956-10-1(4-Nitrophenyl caprylate)
- 28341-53-9(Methyl 4-(p-Nitrophenoxy)butyrate)
- 1956-06-5(4-Nitrophenyl propionate)
- 1956-11-2(4-Nitrophenyl laurate)
- 1956-09-8(4-Nitrophenyl decanoate)
- 14617-86-8(p-Nitrophenyl Stearate)
- 1492-30-4(4-Nitrophenyl palmitate)
- 14617-85-7(4-Nitrophenyl Myristate)
- 2635-84-9(4-Nitrophenyl butyrate)
- 956-75-2(4-Nitrophenyl hexanoate)
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