Cas no 50342-31-9 (Benzene, 1,5-dimethoxy-2-methyl-4-nitro-)
50342-31-9 structure
Product Name:Benzene, 1,5-dimethoxy-2-methyl-4-nitro-
CAS No:50342-31-9
MF:C9H11NO4
MW:197.187942743301
CID:1568438
PubChem ID:57192063
Update Time:2025-10-28
Benzene, 1,5-dimethoxy-2-methyl-4-nitro- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 1,5-dimethoxy-2-methyl-4-nitro-
- DTXSID001287411
- 50342-31-9
- 1,5-dimethoxy-2-methyl-4-nitrobenzene
- SCHEMBL6370714
- LHERHZJOVSKYSF-UHFFFAOYSA-N
- DB-092867
- BS-32494
-
- Inchi： 1S/C9H11NO4/c1-6-4-7(10(11)12)9(14-3)5-8(6)13-2/h4-5H,1-3H3
- InChI Key： LHERHZJOVSKYSF-UHFFFAOYSA-N
- SMILES： O(C)C1C=C(C(=CC=1C)[N+](=O)[O-])OC
Computed Properties
- Exact Mass: 197.06883
- Monoisotopic Mass: 197.06880783g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 204
- 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: 2.4
- Topological Polar Surface Area: 64.3?2
Experimental Properties
- PSA: 61.6
Benzene, 1,5-dimethoxy-2-methyl-4-nitro- Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1736885-1g |
1,5-Dimethoxy-2-methyl-4-nitrobenzene |
50342-31-9 | 98% | 1g |
￥2005.00 | 2024-05-11 |
Benzene, 1,5-dimethoxy-2-methyl-4-nitro- Related Literature
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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
-
Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
-
Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
-
Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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