CID 169430064

C10H26B — CID 169430064

IUPAC—
SMILESCC.CCCC.CCCC.[B]
InChIInChI=1S/2C4H10.C2H6.B/c2*1-3-4-2;1-2;/h2*3-4H2,1-2H3;1-2H3;
InChIKeyCABDXQQDPAUXCJ-UHFFFAOYSA-N
MW157.13 g/mol
LogP4.26
Rot. Bonds2

About CID 169430064

CID 169430064 (PubChem CID 169430064) has the molecular formula C10H26B and a molecular weight of 157.13 g/mol.

Molecular Properties

Compound NameCID 169430064
PubChem CID169430064
Molecular FormulaC10H26B
Molecular Weight157.13 g/mol
Exact Mass157.21
IUPAC Name—
SMILESCC.CCCC.CCCC.[B]
InChIInChI=1S/2C4H10.C2H6.B/c2*1-3-4-2;1-2;/h2*3-4H2,1-2H3;1-2H3;
InChIKeyCABDXQQDPAUXCJ-UHFFFAOYSA-N
XLogP4.26
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.13
LogP ≤ 54.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

butane;ethane;methane
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butane;octahydrofluoride
CID 173254735
butane;methane
CID 169432073
butane;dihydroiodide
CID 173299742
butane;methane
CID 161323740
butane;hydrazine
CID 161056989
azane;butane
CID 18518846
butane;neodymium
CID 173047512
butane;dihydrochloride
CID 175321374
butane;manganese
CID 173124338
butane;sulfane
CID 162203569
butane;lanthanum
CID 174455562

Frequently Asked Questions

What is the IUPAC name of CID 169430064?
The IUPAC name of CID 169430064 (CID 169430064) is not available.
What is the SMILES notation for CID 169430064?
The canonical SMILES for CID 169430064 is CC.CCCC.CCCC.[B].
What is the InChIKey of CID 169430064?
The InChIKey is CABDXQQDPAUXCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C4H10.C2H6.B/c2*1-3-4-2;1-2;/h2*3-4H2,1-2H3;1-2H3;.
What are the key properties of CID 169430064?
CID 169430064 has a molecular weight of 157.13 g/mol, XLogP of 4.26, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 169430064 is sourced from PubChem (CID 169430064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).