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1-methylbutylammonium | SBID = 1700 | Compound |
Custom Molecule
Structure
Molecular Properties
Interactions: |
1
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PubChem TPSA/Å2: |
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Ertl TPSA/Å2: |
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Hydrophilicity (PubChem XLogP): |
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Hydrophilicity (Cheng XLogP3): |
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Charge: |
1.0 |
Number of H-Bond Donors: |
1.0 |
Number of H-Bond Acceptors: |
0.0 |
Number of Stereogenic Bonds (E/Z): |
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Number of Stereogenic Atoms (R/S): |
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3D Volume/Å3: |
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Sum Formula: |
C5H14N+ |
M / g/mol: |
88.17136 |
Complexity: |
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Number of Conformers: |
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Identifiers
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Tags:
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Name:
1-methylbutylammonium
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Preferred Abbreviation:
1-methylbutylammonium
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IUPAC Name:
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CAS:
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CID:
-669
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InChiKey:
IGEIPFLJVCPEKU-UHFFFAOYSA-O
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InChi:
InChI=1S/C5H13N/c1-3-4-5(2)6/h5H,3-4,6H2,1-2H3/p+1
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CanoSmiles:
CCCC([NH3+])C
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IsoSmiles:
CCCC(C)[NH3+]