Cas no 59920-13-7 (Phenol, 2,2'-methylenebis[6-[(2-hydroxy-5-nitrophenyl)methyl]-4-nitro-)
![Phenol, 2,2'-methylenebis[6-[(2-hydroxy-5-nitrophenyl)methyl]-4-nitro- structure](https://ossimg.kuujia.com/scimg/60000/59920-13-7x500.png)
59920-13-7 structure
Product Name:Phenol, 2,2'-methylenebis[6-[(2-hydroxy-5-nitrophenyl)methyl]-4-nitro-
CAS No:59920-13-7
MF:C27H20N4O12
MW:592.467307090759
CID:336833
PubChem ID:71442615
Update Time:2025-04-19
Phenol, 2,2'-methylenebis[6-[(2-hydroxy-5-nitrophenyl)methyl]-4-nitro- Chemical and Physical Properties
Names and Identifiers
-
- Phenol, 2,2'-methylenebis[6-[(2-hydroxy-5-nitrophenyl)methyl]-4-nitro-
- 2-[[2-hydroxy-3-[(2-hydroxy-5-nitrophenyl)methyl]-5-nitrophenyl]methyl]-6-[(2-hydroxy-5-nitrophenyl)methyl]-4-nitrophenol
- 2,2'-{Methylenebis[(2-hydroxy-5-nitro-3,1-phenylene)methylene]}bis(4-nitrophenol)
- 59920-13-7
- DTXSID70851480
-
- Inchi： 1S/C27H20N4O12/c32-24-3-1-20(28(36)37)8-14(24)5-16-10-22(30(40)41)12-18(26(16)34)7-19-13-23(31(42)43)11-17(27(19)35)6-15-9-21(29(38)39)2-4-25(15)33/h1-4,8-13,32-35H,5-7H2
- InChI Key： HYBSWMLALVMFNN-UHFFFAOYSA-N
- SMILES： OC1C(=CC(=CC=1CC1C=C(C=C(CC2C=C(C=CC=2O)[N+](=O)[O-])C=1O)[N+](=O)[O-])[N+](=O)[O-])CC1C=C(C=CC=1O)[N+](=O)[O-]
Computed Properties
- Exact Mass: 592.1078
- Monoisotopic Mass: 592.10777209g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 12
- Heavy Atom Count: 43
- Rotatable Bond Count: 6
- Complexity: 934
- 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: 5.6
- Topological Polar Surface Area: 264?2
Experimental Properties
- PSA: 253.48
Phenol, 2,2'-methylenebis[6-[(2-hydroxy-5-nitrophenyl)methyl]-4-nitro- Related Literature
-
Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
-
Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
-
Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
-
Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
59920-13-7 (Phenol, 2,2'-methylenebis[6-[(2-hydroxy-5-nitrophenyl)methyl]-4-nitro-) Related Products
- 19182-96-8(4-nitro-2-(prop-2-en-1-yl)phenol)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
- 89640-58-4(2-Iodo-4-nitrophenylhydrazine)
- 1449132-38-0(3-Fluoro-5-(2-fluoro-5-methylbenzylcarbamoyl)benzeneboronic acid)
Recommended suppliers
Hangzhou Cedareal Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
Shanghai Bent Chemical Co., Ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
Zhangzhou Sinobioway Peptide Co.,Ltd.
Gold Member
Audited Supplier
CN Supplier
Reagent
Inner Mongolia Xinhong Biological Technology Co., Ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
Nanjing Jubai Biopharm
Gold Member
Audited Supplier
CN Supplier
Bulk
