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(R)-(-)-Tetrahydrofurfurylamine
CAS: 7202-43-9 | C5H11NO
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
7202-43-9
Molecular Formula:
C5H11NO
Molecular Mass:
101.15 g/mol
Names and Synonyms:
(R)-(-)-Tetrahydrofurfurylamine
2-Furanmethanamine, tetrahydro-, (2R)-
2-Furanmethanamine tetrahydro-, (2R)-
Furfurylamine, tetrahydro-, (R)-
2-Furanmethanamine, tetrahydro-, (R)-
(2R)-Tetrahydro-2-furanmethanamine
(-)-(R)-Tetrahydrofurfurylamine
(R)-Tetrahydrofurfurylamine
(R)-(-)-Tetrahydrofurfurylamine
(2R)-Tetrahydrofuran-2-methanamine
[((R)-Tetrahydrofuran-2-yl)methyl]amine
[[(2R)-Tetrahydro-2-furanyl]methyl]amine
(R)-1-(Tetrahydrofuran-2-yl)methylamine
(R)-(Tetrahydrofuran-2-yl)methanamine
(2R)-2-Aminomethyltetrahydrofuran
[(R)-1-(Tetrahydro-furan-2-yl)]-methylamine
(R)-Tetrahydrofuran-2-ylmethylamine
(R)-1-(Tetrahydrofuran-2-yl)methanamine
(R)-(-)-Tetrahydrofurfurylamine
1-[(2R)-Tetrahydrofuran-2-yl]methanamine
[(2R)-Oxolan-2-yl]methanamine
(R)-Tetrahydrofurfurylamine
1-[(2R)-Oxolan-2-yl]methanamine
Identifiers:
SMILES:
NC[C@H]1CCCO1
InChI:
InChI=1S/C5H11NO/c6-4-5-2-1-3-7-5/h5H,1-4,6H2/t5-/m1/s1
Key Properties
Boiling Point
152-153 °C
CAS Common Chemistry
Density
0.98 g/cm³
CAS Common Chemistry
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 | 101.15 g/mol | CAS Common Chemistry |
| 101.149 g/mol | RDKit | |
| 101.084063972 g/mol | RDKit | |
| Density | 0.98 g/cm³ | CAS Common Chemistry |
| 0.98 g/cm3 | CAS Common Chemistry | |
| Boiling Point | 152-153 °C | CAS Common Chemistry |
| Canonical SMILES | O1CCCC1CN | CAS Common Chemistry |
| InChI | InChI=1S/C5H11NO/c6-4-5-2-1-3-7-5/h5H,1-4,6H2/t5-/m1/s1 | CAS Common Chemistry |
| InChI Key | InChIKey=YNOGYQAEJGADFJ-RXMQYKEDSA-N | CAS Common Chemistry |
| Name | (R)-(-)-Tetrahydrofurfurylamine | CAS Common Chemistry |
| Heavy Atom Count | 7 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 1 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 35.25 Ų | RDKit |
| LogP | 0.12409999999999966 | RDKit |
| Molar Refractivity | 28.02839999999999 | RDKit |
