Cas no 53408-96-1 (4-Nitrobenzo-18-crown-6)
4-Nitrobenzo-18-crown-6 structure
Product Name:4-Nitrobenzo-18-crown-6
CAS No:53408-96-1
MF:C16H23NO8
MW:357.35572552681
MDL:MFCD00143207
CID:89759
PubChem ID:87573881
Update Time:2025-04-18
4-Nitrobenzo-18-crown-6 Chemical and Physical Properties
Names and Identifiers
-
- 4-Nitrobenzo-18-crown-6
- 4'-Nitrobenzo-18-crown 6-Ether
- 2,3-(4-NITROBENZO)-1,4,7,10,13,16-HEXAOXACYCLOOCTADEC-2-ENE
- 20-nitro-2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(18),19,21-triene
- Nitrobenzo-18-crown-6
- 2,3,5,6,8,9,11,12,14,15-Decahydro-18-nitro-1,4,7,10,13,16-benzohexaoxacyclooctadecin
- LQXOKBZWNFJJGI-UHFFFAOYSA-N
- LQXOKBZWNFJJGI-UHFFFAOYSA-
- STL089801
- VZ29531
- API
- 18-Nitro-2,3,5,6,8,9,11,12,14,15-decahydro-1,4,7,10,13,16-benzohexaoxacyclooctadecine
- 21-nitro-2,5,8,11,14,17-hexaoxabicyclo[16.4.0]docosa-1(18),19,21-triene
- 18-nitro-2,3,5,6,8,9,11,12,14,15-decahydrobenzo[b][1,4,7,10,13,16]hexaoxacyclooctadecine
- A829571
- SR-01000390240
- T72582
- FT-0619211
- DTXSID10345156
- AKOS001026593
- CS-0322969
- MFCD00143207
- Z56778263
- N0562
- 53408-96-1
- SCHEMBL14849221
- SR-01000390240-1
- F1791-1332
- 4'-Nitrobenzo-18-crown-6
- InChI=1/C16H23NO8/c18-17(19)14-1-2-15-16(13-14)25-12-10-23-8-6-21-4-3-20-5-7-22-9-11-24-15/h1-2,13H,3-12H2
- 18-Nitro-2,3,5,6,8,9,11,12,14,15-decahydro-1,4,7,10,13,16-benzohexaoxacyclooctadecine #
- 4'-Nitrobenzo-18-crown-6-ether
- 4- Nitrobenzo-18-crown-6
- DB-052332
-
- MDL： MFCD00143207
- Inchi： 1S/C16H23NO8/c18-17(19)14-1-2-15-16(13-14)25-12-10-23-8-6-21-4-3-20-5-7-22-9-11-24-15/h1-2,13H,3-12H2
- InChI Key： LQXOKBZWNFJJGI-UHFFFAOYSA-N
- SMILES： O1CCOCCOC2C=C(C=CC=2OCCOCCOCC1)[N+](=O)[O-]
Computed Properties
- Exact Mass: 357.14200
- Monoisotopic Mass: 357.142367
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 25
- Rotatable Bond Count: 0
- Complexity: 365
- 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: 0.1
- Topological Polar Surface Area: 101
- Surface Charge: 0
- Tautomer Count: nothing
Experimental Properties
- Color/Form: powder
- Density: 1.163
- Melting Point: 83.0 to 87.0 deg-C
- Boiling Point: 453.11°C (rough estimate)
- Flash Point: 110 C
- Refractive Index: 1.5230 (estimate)
- PSA: 101.20000
- LogP: 1.95560
- Solubility: Not determined
4-Nitrobenzo-18-crown-6 Security Information
-
Symbol:
- Prompt：warning
- Signal Word：warning
- Hazard Statement： H303-H315-H319
- Warning Statement： P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P312
- WGK Germany：3
- Hazard Category Code： 36/37/38-34-11
- Safety Instruction： S26-S36
- FLUKA BRAND F CODES：3
-
Hazardous Material Identification：
- Risk Phrases：R36/37/38
- Safety Term：S26-S36
- Storage Condition：storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years)
4-Nitrobenzo-18-crown-6 Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd. | N866966-5g |
4'-Nitrobenzo-18-crown 6-Ether |
53408-96-1 | ≥97% | 5g |
2,700.00 | 2021-05-17 | |
| TRC | N900815-10mg |
4-Nitrobenzo-18-crown-6 |
53408-96-1 | 10mg |
$ 50.00 | 2022-06-03 | ||
| TRC | N900815-50mg |
4-Nitrobenzo-18-crown-6 |
53408-96-1 | 50mg |
$ 65.00 | 2022-06-03 | ||
| TRC | N900815-100mg |
4-Nitrobenzo-18-crown-6 |
53408-96-1 | 100mg |
$ 80.00 | 2022-06-03 | ||
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | X70625-1g |
4-Nitrobenzo-18-crown-6 |
53408-96-1 | ≥97% | 1g |
￥478.0 | 2023-09-05 | |
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | X70625-200mg |
4-Nitrobenzo-18-crown-6 |
53408-96-1 | ≥97% | 200mg |
￥138.0 | 2023-09-05 | |
| TI XI AI ( SHANG HAI ) HUA CHENG GONG YE FA ZHAN Co., Ltd. | N0562-1G |
4'-Nitrobenzo-18-crown 6-Ether |
53408-96-1 | >97.0%(GC) | 1g |
￥620.00 | 2023-09-07 | |
| TI XI AI ( SHANG HAI ) HUA CHENG GONG YE FA ZHAN Co., Ltd. | N0562-5G |
4'-Nitrobenzo-18-crown 6-Ether |
53408-96-1 | >97.0%(GC) | 5g |
￥2290.00 | 2023-09-07 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | N0562-1g |
4-Nitrobenzo-18-crown-6 |
53408-96-1 | 97.0%(GC) | 1g |
￥690.0 | 2022-06-10 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | N0562-5g |
4-Nitrobenzo-18-crown-6 |
53408-96-1 | 97.0%(GC) | 5g |
￥2690.0 | 2022-06-10 |
4-Nitrobenzo-18-crown-6 Related Literature
-
Xingkun Luan,Haozheng Wang,Zehong Xiang,Jiruo Zhao,Ying Feng,Qiang Shi,Baijun liu,Yumei Gong,Shing-Chung Wong,Jinghua Yin RSC Adv. 2019 9 5251
-
Marta Zaleskaya,Damian Jagleniec,Marcin Karbarz,?ukasz Dobrzycki,Jan Romański Inorg. Chem. Front. 2020 7 972
-
Damian Jagleniec,?ukasz Dobrzycki,Marcin Karbarz,Jan Romański Chem. Sci. 2019 10 9542
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