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Lauric acid | SBID = 1057 | Compound |
Structure
Molecular Properties
Interactions: |
1
|
PubChem TPSA/Å2: |
37.3 |
Ertl TPSA/Å2: |
|
Hydrophilicity (PubChem XLogP): |
4.2 |
Hydrophilicity (Cheng XLogP3): |
|
Charge: |
0.0 |
Number of H-Bond Donors: |
1.0 |
Number of H-Bond Acceptors: |
2.0 |
Number of Stereogenic Bonds (E/Z): |
0.0 |
Number of Stereogenic Atoms (R/S): |
0.0 |
3D Volume/Å3: |
177.2 |
Sum Formula: |
C12H24O2 |
M / g/mol: |
200.32 |
Complexity: |
132.0 |
Number of Conformers: |
10.0 |
Identifiers
-
Tags:
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Name:
Lauric acid
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Preferred Abbreviation:
lauric acid
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IUPAC Name:
dodecanoic acid
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CAS:
143-07-7
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CID:
3893
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InChiKey:
POULHZVOKOAJMA-UHFFFAOYSA-N
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InChi:
InChI=1S/C12H24O2/c1-2-3-4-5-6-7-8-9-10-11-12(13)14/h2-11H2,1H3,(H,13,14)
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CanoSmiles:
CCCCCCCCCCCC(=O)O
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IsoSmiles:
CCCCCCCCCCCC(=O)O