Cas no 126839-95-0 (4-n-Pentylphenol-2,3,5,6-d4,OD)
126839-95-0 structure
Product Name:4-n-Pentylphenol-2,3,5,6-d4,OD
CAS No:126839-95-0
MF:C11H16O
MW:169.274951934814
CID:137928
PubChem ID:56845929
Update Time:2025-04-19
4-n-Pentylphenol-2,3,5,6-d4,OD Chemical and Physical Properties
Names and Identifiers
-
- Phen-2,3,5,6-d4-ol-d,4-pentyl- (9CI)
- 4-N-PENTYLPHENOL-2,3,5,6-D4, OD
- 4-n-Pentylphenol--d4,OD
- 126839-95-0
- HY-W010112S
- 4-n-Pentylphenol-[d5]
- F91231
- 4-Pentylphenol-d5
- CS-0590603
- Phen-2,3,5,6-d4-ol-d,4-pentyl-(9ci)
- AKOS015910747
- 1,2,4,5-tetradeuterio-3-deuteriooxy-6-pentylbenzene
- 4-N-PENTYLPHENOL-2,3,5,6-D4,OD
- 4-n-Pentylphenol-2,3,5,6-d4,OD
-
- Inchi： 1S/C11H16O/c1-2-3-4-5-10-6-8-11(12)9-7-10/h6-9,12H,2-5H2,1H3/i6D,7D,8D,9D/hD
- InChI Key： ZNPSUQQXTRRSBM-WLWDFMJJSA-N
- SMILES： O([2H])C1C([2H])=C([2H])C(=C([2H])C=1[2H])CCCCC
Computed Properties
- Exact Mass: 174.18288
- Monoisotopic Mass: 169.151
- Isotope Atom Count: 5
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 4
- Complexity: 104
- 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: 3.7
- Topological Polar Surface Area: 20.2A^2
Experimental Properties
- Density: 0.995
- Boiling Point: 250.499 °C at 760 mmHg
- Flash Point: 135.035 °C
- PSA: 9.23
4-n-Pentylphenol-2,3,5,6-d4,OD Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| TRC | P283876-1mg |
4-n-Pentylphenol-2,3,5,6-d4,OD |
126839-95-0 | 1mg |
$ 64.00 | 2023-09-06 | ||
| TRC | P283876-2mg |
4-n-Pentylphenol-2,3,5,6-d4,OD |
126839-95-0 | 2mg |
$81.00 | 2023-05-17 | ||
| TRC | P283876-10mg |
4-n-Pentylphenol-2,3,5,6-d4,OD |
126839-95-0 | 10mg |
$ 115.00 | 2023-09-06 |
4-n-Pentylphenol-2,3,5,6-d4,OD Related Literature
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
-
Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
-
Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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