Cas no 136621-77-7 (1,10-Phenanthroline-4,7-diacetic acid)
136621-77-7 structure
Product Name:1,10-Phenanthroline-4,7-diacetic acid
CAS No:136621-77-7
MF:C16H12N2O4
MW:296.277483940125
CID:1241303
PubChem ID:67945303
Update Time:2025-04-20
1,10-Phenanthroline-4,7-diacetic acid Chemical and Physical Properties
Names and Identifiers
-
- 1,10-Phenanthroline-4,7-diacetic acid
- 2-[7-(carboxymethyl)-1,10-phenanthrolin-4-yl]acetic acid
- SCHEMBL9862809
- 136621-77-7
- 2,2'-(1,10-Phenanthroline-4,7-diyl)diacetic acid
- DTXSID90737833
-
- Inchi： 1S/C16H12N2O4/c19-13(20)7-9-3-5-17-15-11(9)1-2-12-10(8-14(21)22)4-6-18-16(12)15/h1-6H,7-8H2,(H,19,20)(H,21,22)
- InChI Key： CPQODVCKHYUACV-UHFFFAOYSA-N
- SMILES： OC(CC1C=CN=C2C3C(C=CC2=1)=C(C=CN=3)CC(=O)O)=O
Computed Properties
- Exact Mass: 296.07976
- Monoisotopic Mass: 296.07970687g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 22
- Rotatable Bond Count: 4
- Complexity: 402
- 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: 1.4
- Topological Polar Surface Area: 100?2
Experimental Properties
- PSA: 100.38
1,10-Phenanthroline-4,7-diacetic acid Related Literature
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2. An integrated microfluidic 3D tumor system for parallel and high-throughput chemotherapy evaluation?Dan Liu,Rui Hu,Zhongchao Huang,Meilin Sun,Kai Han Analyst, 2020,145, 6447-6455
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
-
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
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