Cas no 118799-18-1 (3-N-Octylpyrrole)
3-N-Octylpyrrole structure
Product Name:3-N-Octylpyrrole
CAS No:118799-18-1
MF:C12H21N
MW:179.30184340477
MDL:MFCD00191474
CID:131963
PubChem ID:87574232
Update Time:2025-04-19
3-N-Octylpyrrole Chemical and Physical Properties
Names and Identifiers
-
- 1H-Pyrrole, 3-octyl-
- 3-n-Octylpyrrole
- 3-<i>n<
- 3-octyl-1H-pyrrole
- i>-Octylpyrrole
- 3-N-OCTYLPYRROLE 95+%
- 3-Octylpyrrole
- 3-octyl-1H-pyrrol
- ATE0000004
- O0241
- 118799-18-1
- MFCD00191474
- SB62180
- CS-0452970
- SCHEMBL152937
- T71621
- AKOS015839937
- BS-52150
- DTXSID30561119
- 3-N-Octylpyrrole
-
- MDL: MFCD00191474
- Inchi: 1S/C12H21N/c1-2-3-4-5-6-7-8-12-9-10-13-11-12/h9-11,13H,2-8H2,1H3
- InChI Key: WFHVTZRAIPYMMO-UHFFFAOYSA-N
- SMILES: N1C=CC(=C1)CCCCCCCC
Computed Properties
- Exact Mass: 179.16700
- Monoisotopic Mass: 179.167399674g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 13
- Rotatable Bond Count: 7
- Complexity: 112
- 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
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 4.8
- Topological Polar Surface Area: 15.8
Experimental Properties
- Color/Form: Not determined
- Density: 0.88
- Boiling Point: 111°C/4mmHg(lit.)
- Flash Point: 112.0±10.0 °C
- Refractive Index: 1.4790 to 1.4830
- PSA: 15.79000
- LogP: 3.91770
- Solubility: Not determined
- Vapor Pressure: 0.0±0.5 mmHg at 25°C
3-N-Octylpyrrole Security Information
-
Symbol:
- Prompt:warning
- Signal Word:warning
- Hazard Statement: H315-H319
- Warning Statement: P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
- Safety Instruction: H303+H313+H333
- Storage Condition:storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years)
3-N-Octylpyrrole Customs Data
- HS CODE:2933990090
- Customs Data:
China Customs Code:
2933990090Overview:
2933990090. Other heterocyclic compounds containing only nitrogen heteroatoms. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%
Declaration elements:
Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date
Summary:
2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
3-N-Octylpyrrole Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Chemenu | CM394682-250mg |
3-n-Octylpyrrole |
118799-18-1 | 95%+ | 250mg |
$*** | 2023-04-03 | |
| Chemenu | CM394682-1g |
3-n-Octylpyrrole |
118799-18-1 | 95%+ | 1g |
$*** | 2023-04-03 | |
| TI XI AI ( SHANG HAI ) HUA CHENG GONG YE FA ZHAN Co., Ltd. | O0241-1G |
3-n-Octylpyrrole |
118799-18-1 | >98.0%(GC) | 1g |
¥790.00 | 2024-04-18 | |
| TI XI AI ( SHANG HAI ) HUA CHENG GONG YE FA ZHAN Co., Ltd. | O0241-5G |
3-n-Octylpyrrole |
118799-18-1 | >98.0%(GC) | 5g |
¥2520.00 | 2024-04-18 | |
| abcr | AB139882-1 g |
3-n-Octylpyrrole, 95%; . |
118799-18-1 | 95% | 1g |
€206.20 | 2023-05-09 | |
| abcr | AB139882-5 g |
3-n-Octylpyrrole, 95%; . |
118799-18-1 | 95% | 5g |
€607.40 | 2023-05-09 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | O0241-1g |
3-N-Octylpyrrole |
118799-18-1 | 95.0%(GC) | 1g |
¥1190.0 | 2022-06-10 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | O0241-5g |
3-N-Octylpyrrole |
118799-18-1 | 95.0%(GC) | 5g |
¥2795.0 | 2022-06-10 | |
| TRC | O293955-50mg |
3-N-Octylpyrrole |
118799-18-1 | 50mg |
$ 70.00 | 2022-06-02 | ||
| TRC | O293955-100mg |
3-N-Octylpyrrole |
118799-18-1 | 100mg |
$ 95.00 | 2022-06-02 |
3-N-Octylpyrrole Related Literature
-
Eunice Y.-L. Hui,Bhimsen Rout,Yaw Sing Tan,Kok-Ping Chan,Charles W. Johannes Org. Biomol. Chem., 2018,16, 389-392
-
Xiao Liu,Jun Xu,Yinyun Lv,Wenyu Wu,Weisheng Liu,Yu Tang Dalton Trans., 2013,42, 9840-9846
-
James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
-
Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
-
Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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