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Molecule
Dipropylamine
CAS: 142-84-7 · C6H15N
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 142-84-7
- Molecular Formula
- C6H15N
- Molecular Mass
- 101.19 g/mol
Identifiers
CAS Registry Number
142-84-7
SMILES
CCCNCCC
InChI Key
WEHWNAOGRSTTBQ-UHFFFAOYSA-N
InChI
InChI=1S/C6H15N/c1-3-5-7-6-4-2/h7H,3-6H2,1-2H3
Names and Synonyms
- Dipropylamine Common Name
- 1-Propanamine, N-propyl- Synonym
- Dipropylamine Synonym
- N-Propyl-1-propanamine Synonym
- Di-n-propylamine Synonym
- n-Dipropylamine Synonym
- Dipropanamine Synonym
- N,N-Dipropylamine Synonym
- N,N-Di(n-propyl)amine Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 101.19 g/mol | CAS Common Chemistry |
| 101.193 g/mol | RDKit | |
| Density | 0.74 g/cm³ | CAS Common Chemistry |
| 0.738 g/cm3 @ 20 °C | CAS Common Chemistry | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Dipropylamine | CAS Common Chemistry |
| Boiling Point | 109.3 °C | CAS Common Chemistry |
| Canonical SMILES | N(CCC)CCC | CAS Common Chemistry |
| InChI | InChI=1S/C6H15N/c1-3-5-7-6-4-2/h7H,3-6H2,1-2H3 | CAS Common Chemistry |
| InChI Key | InChIKey=WEHWNAOGRSTTBQ-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | -63 °C | CAS Common Chemistry |
| Name | Dipropylamine | CAS Common Chemistry |
| Heavy Atom Count | 7 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 4 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 12.03 Ų | RDKit |
| LogP | 1.396 | RDKit |
| Molar Refractivity | 33.45169999999999 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 101.12044947999999 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
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200 ppm
180
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140
120
100
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20
0 ppm
| Shift (ppm) | DEPT | Assignment |
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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 = 101.19 g/mol; density = 0.740 g/mL. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C6H15N.
