benzene;borinine

C11H11B — CID 159272971

IUPACbenzene;borinine
SMILESb1ccccc1.c1ccccc1
InChIInChI=1S/C6H6.C5H5B/c2*1-2-4-6-5-3-1/h1-6H;1-5H
InChIKeyKXYDPZLUXNBEAA-UHFFFAOYSA-N
MW154.02 g/mol
LogP2.71
Rot. Bonds

About benzene;borinine

benzene;borinine (PubChem CID 159272971) has the molecular formula C11H11B and a molecular weight of 154.02 g/mol. Its IUPAC name is benzene;borinine.

Molecular Properties

Compound Namebenzene;borinine
PubChem CID159272971
Molecular FormulaC11H11B
Molecular Weight154.02 g/mol
Exact Mass154.10
IUPAC Namebenzene;borinine
SMILESb1ccccc1.c1ccccc1
InChIInChI=1S/C6H6.C5H5B/c2*1-2-4-6-5-3-1/h1-6H;1-5H
InChIKeyKXYDPZLUXNBEAA-UHFFFAOYSA-N
XLogP2.71
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.02
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of benzene;borinine?
The IUPAC name of benzene;borinine (CID 159272971) is benzene;borinine.
What is the SMILES notation for benzene;borinine?
The canonical SMILES for benzene;borinine is b1ccccc1.c1ccccc1.
What is the InChIKey of benzene;borinine?
The InChIKey is KXYDPZLUXNBEAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6.C5H5B/c2*1-2-4-6-5-3-1/h1-6H;1-5H.
What are the key properties of benzene;borinine?
benzene;borinine has a molecular weight of 154.02 g/mol, XLogP of 2.71, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for benzene;borinine is sourced from PubChem (CID 159272971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).