CID 173015754

C17H37O2Sn — CID 173015754

IUPAC—
SMILESCC(C)[Sn](C(C)C)C(C)C.CCCCC(CC)C(=O)O
InChIInChI=1S/C8H16O2.3C3H7.Sn/c1-3-5-6-7(4-2)8(9)10;3*1-3-2;/h7H,3-6H2,1-2H3,(H,9,10);3*3H,1-2H3;
InChIKeyGXEQAKSYQAGJBE-UHFFFAOYSA-N
MW392.19 g/mol
LogP6.00
Rot. Bonds8

About CID 173015754

CID 173015754 (PubChem CID 173015754) has the molecular formula C17H37O2Sn and a molecular weight of 392.19 g/mol.

Molecular Properties

Compound NameCID 173015754
PubChem CID173015754
Molecular FormulaC17H37O2Sn
Molecular Weight392.19 g/mol
Exact Mass393.18
IUPAC Name—
SMILESCC(C)[Sn](C(C)C)C(C)C.CCCCC(CC)C(=O)O
InChIInChI=1S/C8H16O2.3C3H7.Sn/c1-3-5-6-7(4-2)8(9)10;3*1-3-2;/h7H,3-6H2,1-2H3,(H,9,10);3*3H,1-2H3;
InChIKeyGXEQAKSYQAGJBE-UHFFFAOYSA-N
XLogP6.00
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.19
LogP ≤ 56.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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bis(2-ethylhexanoic acid);manganese
CID 173402583
bis(2-ethylhexanoic acid);manganese(3+)
CID 175736722
tris(2-ethylhexanoic acid);propan-2-yl-λ2-stannane
CID 173133127
cobalt;bis(2-ethylhexanoic acid);nickel
CID 173442875
2-ethylhexanoic acid;hexadecane
CID 174408772
barium(2+);2-ethylhexanoic acid;hydride
CID 172997422
CID 87238691
CID 87238691

Frequently Asked Questions

What is the IUPAC name of CID 173015754?
The IUPAC name of CID 173015754 (CID 173015754) is not available.
What is the SMILES notation for CID 173015754?
The canonical SMILES for CID 173015754 is CC(C)[Sn](C(C)C)C(C)C.CCCCC(CC)C(=O)O.
What is the InChIKey of CID 173015754?
The InChIKey is GXEQAKSYQAGJBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O2.3C3H7.Sn/c1-3-5-6-7(4-2)8(9)10;3*1-3-2;/h7H,3-6H2,1-2H3,(H,9,10);3*3H,1-2H3;.
What are the key properties of CID 173015754?
CID 173015754 has a molecular weight of 392.19 g/mol, XLogP of 6.00, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 173015754 is sourced from PubChem (CID 173015754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).