Cas no 62000-10-6 (Benzene, 2-nitro-1,3-bis(phenylmethoxy)-)
62000-10-6 structure
Product Name:Benzene, 2-nitro-1,3-bis(phenylmethoxy)-
CAS No:62000-10-6
MF:C20H17NO4
MW:335.353285551071
CID:461057
PubChem ID:71390766
Update Time:2025-04-19
Benzene, 2-nitro-1,3-bis(phenylmethoxy)- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 2-nitro-1,3-bis(phenylmethoxy)-
- 2-nitro-1,3-bis(phenylmethoxy)benzene
- AXXIQEWXEWOVLS-UHFFFAOYSA-N
- 62000-10-6
- 1,3-bis(benzyloxy)-2-nitrobenzene
- DTXSID00812665
- SCHEMBL15013285
- 1,1'-[(2-Nitro-1,3-phenylene)bis(oxymethylene)]dibenzene
-
- Inchi： 1S/C20H17NO4/c22-21(23)20-18(24-14-16-8-3-1-4-9-16)12-7-13-19(20)25-15-17-10-5-2-6-11-17/h1-13H,14-15H2
- InChI Key： AXXIQEWXEWOVLS-UHFFFAOYSA-N
- SMILES： O(CC1C=CC=CC=1)C1C=CC=C(C=1[N+](=O)[O-])OCC1C=CC=CC=1
Computed Properties
- Exact Mass: 335.11581
- Monoisotopic Mass: 335.11575802g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 25
- Rotatable Bond Count: 6
- Complexity: 369
- 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: 4.7
- Topological Polar Surface Area: 64.3?2
Experimental Properties
- PSA: 61.6
Benzene, 2-nitro-1,3-bis(phenylmethoxy)- Related Literature
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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