butyl-cyclopentyl-methylborane

C10H21B — CID 173480770

IUPACbutyl-cyclopentyl-methylborane
SMILESCCCCB(C)C1CCCC1
InChIInChI=1S/C10H21B/c1-3-4-9-11(2)10-7-5-6-8-10/h10H,3-9H2,1-2H3
InChIKeySKKAETGMBOPJON-UHFFFAOYSA-N
MW152.09 g/mol
LogP3.86
Rot. Bonds4

About butyl-cyclopentyl-methylborane

butyl-cyclopentyl-methylborane (PubChem CID 173480770) has the molecular formula C10H21B and a molecular weight of 152.09 g/mol. Its IUPAC name is butyl-cyclopentyl-methylborane.

Molecular Properties

Compound Namebutyl-cyclopentyl-methylborane
PubChem CID173480770
Molecular FormulaC10H21B
Molecular Weight152.09 g/mol
Exact Mass152.17
IUPAC Namebutyl-cyclopentyl-methylborane
SMILESCCCCB(C)C1CCCC1
InChIInChI=1S/C10H21B/c1-3-4-9-11(2)10-7-5-6-8-10/h10H,3-9H2,1-2H3
InChIKeySKKAETGMBOPJON-UHFFFAOYSA-N
XLogP3.86
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.09
LogP ≤ 53.86
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;bis(hexane);bis(methylcyclopentane)
CID 162195101
cis-(1R,2S)-1,2-dimethylcyclohexane;heptane
CID 142453951
1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;cyclopentane;hexane;propane
CID 173273683
ethane;tris(methylcyclohexane);octane
CID 142912940
1-butyl-4-(2-cyclopentylethyl)cyclohexane
CID 157379859
heptane;methoxycyclopentane
CID 131735357
[(Z)-1-chlorohept-2-en-2-yl]-dicyclohexylborane
CID 135048835
1-(3-butylheptyl)-6-methylcyclodecane
CID 135036007
3-(chloromethyl)heptan-3-ylcycloheptane
CID 82945588
1,2-dibutoxycyclohexane
CID 24962665
butan-1-ol;cyclopentanol
CID 67930913
tetradecylcyclododecane
CID 169026037

Frequently Asked Questions

What is the IUPAC name of butyl-cyclopentyl-methylborane?
The IUPAC name of butyl-cyclopentyl-methylborane (CID 173480770) is butyl-cyclopentyl-methylborane.
What is the SMILES notation for butyl-cyclopentyl-methylborane?
The canonical SMILES for butyl-cyclopentyl-methylborane is CCCCB(C)C1CCCC1.
What is the InChIKey of butyl-cyclopentyl-methylborane?
The InChIKey is SKKAETGMBOPJON-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21B/c1-3-4-9-11(2)10-7-5-6-8-10/h10H,3-9H2,1-2H3.
What are the key properties of butyl-cyclopentyl-methylborane?
butyl-cyclopentyl-methylborane has a molecular weight of 152.09 g/mol, XLogP of 3.86, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for butyl-cyclopentyl-methylborane is sourced from PubChem (CID 173480770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).