Cas no 13684-31-6 ([1,1'-Biphenyl]-4-ol,3,4',5-trinitro-)
![[1,1'-Biphenyl]-4-ol,3,4',5-trinitro- structure](https://ossimg.kuujia.com/scimg/14000/13684-31-6x500.png)
13684-31-6 structure
Product Name:[1,1'-Biphenyl]-4-ol,3,4',5-trinitro-
CAS No:13684-31-6
MF:C12H7N3O7
MW:305.199882745743
CID:228572
PubChem ID:262250
Update Time:2025-04-19
[1,1'-Biphenyl]-4-ol,3,4',5-trinitro- Chemical and Physical Properties
Names and Identifiers
-
- [1,1'-Biphenyl]-4-ol,3,4',5-trinitro-
- 2,6-dinitro-4-(4-nitrophenyl)phenol
- MLS002695314
- 13684-31-6
- AKOS005446747
- CHEMBL1722625
- NSC 95697
- DTXSID60294281
- SMR001561220
- HMS3092A21
- NSC95697
- 3,5,4'-trinitro-4-hydroxy-biphenyl
- NSC-95697
-
- Inchi： 1S/C12H7N3O7/c16-12-10(14(19)20)5-8(6-11(12)15(21)22)7-1-3-9(4-2-7)13(17)18/h1-6,16H
- InChI Key： FHTDWPRNGLZIRR-UHFFFAOYSA-N
- SMILES： OC1=C(C=C(C=C1[N+](=O)[O-])C1C=CC(=CC=1)[N+](=O)[O-])[N+](=O)[O-]
Computed Properties
- Exact Mass: 305.02839957g/mol
- Monoisotopic Mass: 305.02839957g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 22
- Rotatable Bond Count: 1
- Complexity: 423
- 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: 3.2
- Topological Polar Surface Area: 158?2
[1,1'-Biphenyl]-4-ol,3,4',5-trinitro- Related Literature
-
Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
-
Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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4. 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
-
Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
13684-31-6 ([1,1'-Biphenyl]-4-ol,3,4',5-trinitro-) Related Products
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