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N-(furan-2-ylmethyl)propan-1-amine | SBID = 554 | Compound |
Custom Molecule
Structure
Molecular Properties
| Interactions: |
2
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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: |
0.0 |
| Number of H-Bond Donors: |
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| Number of H-Bond Acceptors: |
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| 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: |
C8H13NO |
| M / g/mol: |
139.2 |
| Complexity: |
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| Number of Conformers: |
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Identifiers
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Tags:
typical guest
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Name:
N-(furan-2-ylmethyl)propan-1-amine
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Preferred Abbreviation:
N-(furanylmethyl)propanamine
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IUPAC Name:
N-(furan-2-ylmethyl)propan-1-amine
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CAS:
39191-12-3
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CID:
-127
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InChiKey:
LPPWAQZJYMWSHG-UHFFFAOYSA-N
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InChi:
InChI=1S/C8H13NO/c1-2-5-9-7-8-4-3-6-10-8/h3-4,6,9H,2,5,7H2,1H3
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CanoSmiles:
CCCNCC1=CC=CO1
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IsoSmiles:
CCCNCC1=CC=CO1