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Molecule
(R)-(-)-Tetrahydrofurfurylamine
CAS: 7202-43-9 · C5H11NO
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 7202-43-9
- Molecular Formula
- C5H11NO
- Molecular Mass
- 101.15 g/mol
Identifiers
CAS Registry Number
7202-43-9
SMILES
NC[C@H]1CCCO1
InChI Key
YNOGYQAEJGADFJ-RXMQYKEDSA-N
InChI
InChI=1S/C5H11NO/c6-4-5-2-1-3-7-5/h5H,1-4,6H2/t5-/m1/s1
Names and Synonyms
- (R)-(-)-Tetrahydrofurfurylamine Synonym
- 2-Furanmethanamine, tetrahydro-, (2R)- Synonym
- 2-Furanmethanamine tetrahydro-, (2R)- Synonym
- Furfurylamine, tetrahydro-, (R)- Synonym
- 2-Furanmethanamine, tetrahydro-, (R)- Synonym
- (2R)-Tetrahydro-2-furanmethanamine Synonym
- (-)-(R)-Tetrahydrofurfurylamine Synonym
- (R)-Tetrahydrofurfurylamine Synonym
- (R)-(-)-Tetrahydrofurfurylamine Synonym
- (2R)-Tetrahydrofuran-2-methanamine Synonym
- [((R)-Tetrahydrofuran-2-yl)methyl]amine Synonym
- [[(2R)-Tetrahydro-2-furanyl]methyl]amine Synonym
- (R)-1-(Tetrahydrofuran-2-yl)methylamine Synonym
- (R)-(Tetrahydrofuran-2-yl)methanamine Synonym
- (2R)-2-Aminomethyltetrahydrofuran Synonym
- [(R)-1-(Tetrahydro-furan-2-yl)]-methylamine Synonym
- (R)-Tetrahydrofuran-2-ylmethylamine Synonym
- (R)-1-(Tetrahydrofuran-2-yl)methanamine Synonym
- (R)-(-)-Tetrahydrofurfurylamine Synonym
- 1-[(2R)-Tetrahydrofuran-2-yl]methanamine Synonym
- [(2R)-Oxolan-2-yl]methanamine Synonym
- (R)-Tetrahydrofurfurylamine Synonym
- 1-[(2R)-Oxolan-2-yl]methanamine Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 101.15 g/mol | CAS Common Chemistry |
| 101.149 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 |
| 0.1241 | RDKit | |
| Molar Refractivity | 28.02839999999999 cm³/mol | RDKit |
| Ring Count | 1 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 101.084063972 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
9
8
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5
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3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
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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.
External Resources
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MW = 101.15 g/mol; density = 0.980 g/mL. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C5H11NO.
