Chemical Name - 2-Amino-2-Methyl-1,3-Propanediol
Mol Weight - 105.136
Smiles - CC(CO)(CO)N
Mol Weight - 105.136
Smiles - CC(CO)(CO)N
| Property Value | |
| Mol Name | 2-Amino-2-Methyl-1,3-Propanediol |
| Molweight | 105.136 |
| Monoisotopic Mass | 105.078979 |
| Clogp | -1.4608 |
| Clogs | -0.026 |
| H Acceptors | 3 |
| H Donors | 3 |
| Total Surface Area | 84.91 |
| Relative Psa | 0.4884 |
| Polar Surface Area | 66.48 |
| Druglikeness | -9.0988 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Shape Index | 0.71429 |
| Molecular Flexibility | 0.8176 |
| Molecular Complexity | 0.69315 |
| Fragments | 1 |
| Non H Atoms | 7 |
| Non Ch Atoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bonds | 2 |
| Sp3 Atoms | 7 |
| Symmetric Atoms | 2 |
| Amines | 1 |
| Alkyl Amines | 1 |
| Basic Nitrogens | 1 |
| Smiles | CC(CO)(CO)N |
| InChIKey | InChI=1S/C4H11NO2/c1-4(5,2-6)3-7/h6-7H,2-3,5H2,1H3 |
| InChI | UXFQFBNBSPQBJW-UHFFFAOYSA-N |
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1 - 2-Amino-2-Methyl-1,3-Propanediol
2 - 2-Amino-2-Methyl-1,3-Propanediol
1 - 2-Amino-2-Methyl-1,3-Propanediol
2 - 2-Amino-2-Methyl-1,3-Propanediol
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