Cas no 1228182-42-0 (Propyl Chloroformate-d7)
Propyl Chloroformate-d7 is a deuterated derivative of propyl chloroformate, where seven hydrogen atoms are replaced by deuterium. This isotopic labeling enhances its utility in mass spectrometry and NMR studies, providing improved signal resolution and reduced interference in analytical applications. The compound is commonly employed as a derivatization agent for carboxylic acids and amines, facilitating their detection and quantification. Its high isotopic purity ensures reliable results in trace analysis and metabolic studies. Propyl Chloroformate-d7 is particularly valuable in pharmacokinetic and proteomic research, where precise labeling is critical for tracking molecular pathways. The compound is handled under standard safety protocols due to its reactivity.
Propyl Chloroformate-d7 structure
Product Name:Propyl Chloroformate-d7
CAS No:1228182-42-0
MF:C4H7ClO2
MW:129.593312501907
CID:4457118
PubChem ID:71309707
Update Time:2025-05-28
Propyl Chloroformate-d7 Chemical and Physical Properties
Names and Identifiers
-
- 1,1,2,2,3,3,3-heptadeuteriopropyl carbonochloridate
- Propyl ChloroforMate-d7
- QQKDTTWZXHEGAQ-NCKGIQLSSA-N
- [2H7]-Propyl Chloroformate
- Propyl Chloroformate-d7 (2.5 mg/mL in Acetonitrile)
- DTXCID90696719
- (~2~H_7_)Propyl carbonochloridate
- DTXSID10745975
- (1,1,2,2,3,3,3-?H?)propyl carbonochloridate
- Propyl-d7 chloroformate, 98 atom % D, 97% (CP)
- 1228182-42-0
- Propyl Chloroformate-d7
-
- Inchi： 1S/C4H7ClO2/c1-2-3-7-4(5)6/h2-3H2,1H3/i1D3,2D2,3D2
- InChI Key： QQKDTTWZXHEGAQ-NCKGIQLSSA-N
- SMILES： ClC(=O)OC([2H])([2H])C([2H])([2H])C([2H])([2H])[2H]
Computed Properties
- Exact Mass: 129.0573944g/mol
- Monoisotopic Mass: 129.0573944g/mol
- Isotope Atom Count: 7
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 7
- Rotatable Bond Count: 3
- Complexity: 62.7
- 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: 2.3
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- Density: 1.1±0.1 g/cm3
- Boiling Point: 116.2±9.0 °C at 760 mmHg
- Flash Point: 28.9±0.0 °C
- Vapor Pressure: 18.4±0.2 mmHg at 25°C
Propyl Chloroformate-d7 Security Information
- Signal Word：warning
- Hazard Statement： H303May be harmful if swallowed+H313Skin contact may be harmful+H333Inhalation may be harmful to the body
- Warning Statement： P264+P280+P305+P351+P338+P337+P313
- Safety Instruction： H303+H313+H333
- Storage Condition：storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years)
Propyl Chloroformate-d7 Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| TRC | P835122-25mg |
Propyl Chloroformate-d7 |
1228182-42-0 | 25mg |
$ 224.00 | 2023-09-06 | ||
| TRC | P835122-250mg |
Propyl Chloroformate-d7 |
1228182-42-0 | 250mg |
$ 1695.00 | 2023-09-06 | ||
| AN HUI ZE SHENG Technology Co., Ltd. | P835122-25mg |
Propyl-d7carbonochloridate |
1228182-42-0 | 25mg |
￥2100.00 | 2023-09-15 | ||
| AN HUI ZE SHENG Technology Co., Ltd. | P835122-250mg |
Propyl-d7carbonochloridate |
1228182-42-0 | 250mg |
￥16800.00 | 2023-09-15 | ||
| AN HUI ZE SHENG Technology Co., Ltd. | CS-T-60831-25mg |
Propyl-d7carbonochloridate |
1228182-42-0 | 25mg |
￥1400.00 | 2023-09-15 | ||
| AN HUI ZE SHENG Technology Co., Ltd. | CS-T-60831-250mg |
Propyl-d7carbonochloridate |
1228182-42-0 | 250mg |
￥10910.00 | 2023-09-15 |
Propyl Chloroformate-d7 Related Literature
-
Piotr Szcze?niak,Sebastian Stecko RSC Adv., 2015,5, 30882-30888
-
Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
-
Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
-
James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
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