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Molecule
Aminomethyl Propanol
CAS: 124-68-5 · C4H11NO
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 124-68-5
- Molecular Formula
- C4H11NO
- Molecular Mass
- 89.14 g/mol
Identifiers
CAS Registry Number
124-68-5
SMILES
CC(C)(N)CO
InChI Key
CBTVGIZVANVGBH-UHFFFAOYSA-N
InChI
InChI=1S/C4H11NO/c1-4(2,5)3-6/h6H,3,5H2,1-2H3
Names and Synonyms
- Aminomethyl Propanol Common Name
- 1-Propanol, 2-amino-2-methyl- Synonym
- 2-Amino-2-methyl-1-propanol Synonym
- β-Aminoisobutanol Synonym
- 2-Amino-2-methylpropanol Synonym
- Isobutanol-2-amine Synonym
- 2-Methyl-2-aminopropanol Synonym
- 2-Aminoisobutanol Synonym
- 1,1-Dimethyl-2-hydroxyethylamine Synonym
- 2-Methyl-2-amino-1-propanol Synonym
- 2-Amino-2,2-dimethylethanol Synonym
- Hydroxy-tert-butylamine Synonym
- 2-Hydroxymethyl-2-propylamine Synonym
- 2-Amino-1-hydroxy-2-methylpropane Synonym
- AMP Regular Synonym
- AMP 95 Synonym
- 2,2-Dimethylethanolamine Synonym
- 2-Hydroxy-1,1-dimethylethylamine Synonym
- AMP Synonym
- AMP (thinner) Synonym
- KV 5088 Synonym
- Corrguard 75 Synonym
- AMP 75 Synonym
- NSC 441 Synonym
- AMP 90 (amine) Synonym
- AMP 90 Synonym
- Pamabron Synonym
- AMP 100 Synonym
- 1-Hydroxy-2-methylpropan-2-amine Synonym
- AMP-ULTRA PC 2000 Synonym
- AMP-Ultra PC 1000 Synonym
- AMP buffer Synonym
- Dolapix A 88 Synonym
- CE 64 Synonym
- AMP-Ultra PC Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 89.14 g/mol | CAS Common Chemistry |
| 89.13799999999999 g/mol | RDKit | |
| 89.138 g/mol | RDKit | |
| Density | 0.93 g/cm³ | CAS Common Chemistry |
| 0.934 g/cm3 @ 20 °C | CAS Common Chemistry | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Aminomethyl_propanol | CAS Common Chemistry |
| Canonical SMILES | OCC(N)(C)C | CAS Common Chemistry |
| InChI | InChI=1S/C4H11NO/c1-4(2,5)3-6/h6H,3,5H2,1-2H3 | CAS Common Chemistry |
| InChI Key | InChIKey=CBTVGIZVANVGBH-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 31 °C | CAS Common Chemistry |
| Name | 2-Amino-2-methyl-1-propanol | CAS Common Chemistry |
| Aminomethyl propanol | CAS Common Chemistry | |
| Heavy Atom Count | 6 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 2 | RDKit |
| Rotatable Bonds | 1 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 46.25 Ų | RDKit |
| LogP | -0.2840000000000001 | RDKit |
| -0.284 | RDKit | |
| Molar Refractivity | 25.352199999999996 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 89.084063972 g/mol | RDKit |
| Boiling Point | 165 °C @ 760 Torr | CAS Common Chemistry |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
9
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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 = 89.14 g/mol; density = 0.930 g/mL. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C4H11NO.
