Chemical Name - N-Pentane
Mol Weight - 72.1503
Smiles - CCCCC
Mol Weight - 72.1503
Smiles - CCCCC
| Property Value | |
| Mol Name | N-Pentane |
| Molweight | 72.1503 |
| Monoisotopic Mass | 72.0939 |
| Clogp | 2.3404 |
| Clogs | -1.794 |
| Total Surface Area | 79.3 |
| Druglikeness | -4.6976 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Shape Index | 1 |
| Molecular Flexibility | 0.43555 |
| Molecular Complexity | 0.34657 |
| Fragments | 1 |
| Non H Atoms | 5 |
| Rotatable Bonds | 2 |
| Sp3 Atoms | 5 |
| Symmetric Atoms | 2 |
| Smiles | CCCCC |
| InChIKey | InChI=1S/C5H12/c1-3-5-4-2/h3-5H2,1-2H3 |
| InChI | OFBQJSOFQDEBGM-UHFFFAOYSA-N |
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1 - N-Pentane
2 - N-Pentane
1 - N-Pentane
2 - N-Pentane
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