CID 169431970

C2H8B — CID 169431970

IUPAC—
SMILESC.[2H]C.[B]
InChIInChI=1S/2CH4.B/h2*1H4;/i1D;;
InChIKeyWJZOGYZUTLBHBV-QCNSCHFVSA-N
MW43.90 g/mol
LogP0.89
Rot. Bonds

About CID 169431970

CID 169431970 (PubChem CID 169431970) has the molecular formula C2H8B and a molecular weight of 43.90 g/mol.

Molecular Properties

Compound NameCID 169431970
PubChem CID169431970
Molecular FormulaC2H8B
Molecular Weight43.90 g/mol
Exact Mass44.08
IUPAC Name—
SMILESC.[2H]C.[B]
InChIInChI=1S/2CH4.B/h2*1H4;/i1D;;
InChIKeyWJZOGYZUTLBHBV-QCNSCHFVSA-N
XLogP0.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms3
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50043.90
LogP ≤ 50.89
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

deuteriomethane;methane;tritiomethane
CID 157071765
methane;molecular chlorine
CID 159642020
CID 174961663
CID 174961663
deuteriomethane;ethane;fluoromethane
CID 158043192
CID 160990607
CID 160990607
CID 174516632
CID 174516632
CID 159089623
CID 159089623
CID 159641533
CID 159641533
CID 161395779
CID 161395779
methane
CID 169425837
(2H)iodane;methane
CID 158868729
CID 159798563
CID 159798563

Frequently Asked Questions

What is the IUPAC name of CID 169431970?
The IUPAC name of CID 169431970 (CID 169431970) is not available.
What is the SMILES notation for CID 169431970?
The canonical SMILES for CID 169431970 is C.[2H]C.[B].
What is the InChIKey of CID 169431970?
The InChIKey is WJZOGYZUTLBHBV-QCNSCHFVSA-N. The full InChI is InChI=1S/2CH4.B/h2*1H4;/i1D;;.
What are the key properties of CID 169431970?
CID 169431970 has a molecular weight of 43.90 g/mol, XLogP of 0.89, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 169431970 is sourced from PubChem (CID 169431970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).