Cas no 167750-79-0 (Benzylamine-d7)
Benzylamine-d7 is a deuterated derivative of benzylamine, where seven hydrogen atoms are replaced with deuterium (D). This isotopic labeling enhances the compound's utility in NMR spectroscopy and mass spectrometry, providing distinct spectral signatures for precise structural elucidation and tracking in mechanistic studies. Its high isotopic purity (typically ≥98% D) ensures minimal interference from protonated species, making it valuable in kinetic and metabolic research. Benzylamine-d7 is also employed as a building block in organic synthesis, particularly in pharmaceutical and agrochemical applications, where deuterium incorporation can modify pharmacokinetic properties. The compound’s stability and compatibility with standard reaction conditions further underscore its versatility in research and industrial settings.
Benzylamine-d7 structure
Product Name:Benzylamine-d7
CAS No:167750-79-0
MF:C7H9N
MW:114.19619345665
MDL:MFCD01074308
CID:137955
Update Time:2025-10-17
Benzylamine-d7 Chemical and Physical Properties
Names and Identifiers
-
- Benzene-d5-methan-d2-amine(9CI)
- < D7> benzylamine
- 495859_ALDRICH
- Benzyl-2,3,4,5,6-d5 cyanide
- Benzyl-d5 cyanide
- C,C-dideuterio-C-pentadeuteriophenyl-methylamine
- Heptadeuterobenzylamin
- pentadeuteriophenylacetonitrile
- BENZYL-D7-AMINE
- Benzylamine-d7
-
- MDL： MFCD01074308
- Inchi： 1S/C7H9N/c8-6-7-4-2-1-3-5-7/h1-5H,6,8H2/i1D,2D,3D,4D,5D,6D2
- InChI Key： WGQKYBSKWIADBV-XZJKGWKKSA-N
- SMILES： NC([2H])([2H])C1C([2H])=C([2H])C([2H])=C([2H])C=1[2H]
Computed Properties
- Exact Mass: 114.117
- Monoisotopic Mass: 114.117
- Isotope Atom Count: 7
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 8
- Rotatable Bond Count: 1
- Complexity: 55.4
- 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: 1.1
- Topological Polar Surface Area: 26A^2
Benzylamine-d7 Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| TRC | B224863-10mg |
Benzylamine-d7 |
167750-79-0 | 10mg |
$ 170.00 | 2023-04-18 | ||
| TRC | B224863-25mg |
Benzylamine-d7 |
167750-79-0 | 25mg |
$ 265.00 | 2023-04-18 | ||
| TRC | B224863-50mg |
Benzylamine-d7 |
167750-79-0 | 50mg |
$ 488.00 | 2023-04-18 | ||
| TRC | B224863-100mg |
Benzylamine-d7 |
167750-79-0 | 100mg |
$ 856.00 | 2023-04-18 | ||
| SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd. | B874754-100mg |
Benzylamine-d7 |
167750-79-0 | ≥98 atom % D | 100mg |
￥1,990.00 | 2022-09-02 | |
| A2B Chem LLC | AE80824-100mg |
BENZYL-D7-AMINE |
167750-79-0 | 99 | 100mg |
$574.00 | 2024-04-20 | |
| A2B Chem LLC | AE80824-250mg |
BENZYL-D7-AMINE |
167750-79-0 | 99%D | 250mg |
$788.00 | 2024-04-20 | |
| 1PlusChem | 1P00ABMG-100mg |
BENZYL-D7-AMINE |
167750-79-0 | 100mg |
$574.00 | 2025-02-25 | ||
| AstaTech | D98733-0.1/G |
BENZYL-D7-AMINE |
167750-79-0 | 95% | 0.1g |
$535 | 2023-09-19 | |
| AstaTech | D98733-0.25/G |
BENZYL-D7-AMINE |
167750-79-0 | 95% | 0.25g |
$954 | 2023-09-19 |
Benzylamine-d7 Related Literature
-
Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
-
Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
-
Benjamin Gabriel Poulson,Kacper Szczepski,Joanna Izabela Lachowicz,Lukasz Jaremko,Abdul-Hamid Emwas,Mariusz Jaremko RSC Adv., 2020,10, 215-227
-
Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
-
Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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