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2-Cyanoethyl Tetraisopropylphosphorodiamidite
CAS: 102691-36-1 | C15H32N3OP
2D Structure
3D Structure
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Basic Information
CAS Registry Number:
102691-36-1
Molecular Formula:
C15H32N3OP
Molecular Mass:
301.42 g/mol
Names and Synonyms:
2-Cyanoethyl Tetraisopropylphosphorodiamidite
Phosphorodiamidous acid, N,N,N′,N′-tetrakis(1-methylethyl)-, 2-cyanoethyl ester
Phosphorodiamidous acid, tetrakis(1-methylethyl)-, 2-cyanoethyl ester
2-Cyanoethoxybis(N,N-diisopropylamino)phosphine
Bis(diisopropylamino)(2-cyanoethoxy)phosphine
β-Cyanoethyl N,N,N′,N′-tetraisopropylphosphorodiamidite
β-Cyanoethyl-N,N,N′,N′-tetraisopropyldiamidophosphite
2-Cyanoethyl-N,N,N1,N1-tetraisopropylphosphorodiamidite
Bis(diisopropylamino)-2-cyanoethoxyphosphane
2-Cyanoethyl tetraisopropylphosphorodiamidite
2-Cyanoethyl N,N,N′,N′-tetraisopropylphosphordiamidite
3-Bis(diisopropylamino)phosphanyloxypropanenitrile
2-Cyanoethyl N,N,N,N-tetraisopropyl phosphoramidite
3-([Bis[bis(propan-2-yl)amino]phosphanyl]oxy)propanenitrile
3-Bis[di(propan-2-yl)amino]phosphanyloxypropanenitrile
3-((Bis(diisopropylamino)phosphino)oxy)propanenitrile
(2-Cyanoethoxy)bis(diisopropylamino)phosphine
Identifiers:
SMILES:
CC(C)N(C(C)C)P(OCCC#N)N(C(C)C)C(C)C
InChI:
InChI=1S/C15H32N3OP/c1-12(2)17(13(3)4)20(19-11-9-10-16)18(14(5)6)15(7)8/h12-15H,9,11H2,1-8H3
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 301.42 g/mol | CAS Common Chemistry |
| 301.415 g/mol | RDKit | |
| 301.22829927399994 g/mol | RDKit | |
| Canonical SMILES | N#CCCOP(N(C(C)C)C(C)C)N(C(C)C)C(C)C | CAS Common Chemistry |
| InChI | InChI=1S/C15H32N3OP/c1-12(2)17(13(3)4)20(19-11-9-10-16)18(14(5)6)15(7)8/h12-15H,9,11H2,1-8H3 | CAS Common Chemistry |
| InChI Key | InChIKey=RKVHNYJPIXOHRW-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | 2-Cyanoethyl tetraisopropylphosphorodiamidite | CAS Common Chemistry |
| Heavy Atom Count | 20 | RDKit |
| Hydrogen Bond Acceptors | 4 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 9 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 39.5 Ų | RDKit |
| LogP | 4.381180000000004 | RDKit |
| Molar Refractivity | 87.32400000000007 | RDKit |
