difluoro(pyrrolidin-1-yl)borane

C4H8BF2N — CID 134862692

IUPACdifluoro(pyrrolidin-1-yl)borane
SMILESFB(F)N1CCCC1
InChIInChI=1S/C4H8BF2N/c6-5(7)8-3-1-2-4-8/h1-4H2
InChIKeyOUSZAPLFRGOKRO-UHFFFAOYSA-N
MW118.92 g/mol
LogP1.01
Rot. Bonds1

About difluoro(pyrrolidin-1-yl)borane

difluoro(pyrrolidin-1-yl)borane (PubChem CID 134862692) has the molecular formula C4H8BF2N and a molecular weight of 118.92 g/mol. Its IUPAC name is difluoro(pyrrolidin-1-yl)borane.

Molecular Properties

Compound Namedifluoro(pyrrolidin-1-yl)borane
PubChem CID134862692
Molecular FormulaC4H8BF2N
Molecular Weight118.92 g/mol
Exact Mass119.07
IUPAC Namedifluoro(pyrrolidin-1-yl)borane
SMILESFB(F)N1CCCC1
InChIInChI=1S/C4H8BF2N/c6-5(7)8-3-1-2-4-8/h1-4H2
InChIKeyOUSZAPLFRGOKRO-UHFFFAOYSA-N
XLogP1.01
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.92
LogP ≤ 51.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1,1-Dimethylpyrrolidinium tetrafluoroborate
CID 12469151
Potassium trifluoro[(pyrrolidin-1-yl)methyl]borate
CID 45588176
Trifluoro(pyrrolidin-1-ylmethyl)borate
CID 23653591
Difluoro(pyrrolidin-1-ylmethyl)borane
CID 55270577
1,1-Difluoropyrrolidin-1-ium
CID 57502876
Trifluoro-(1-methylpyrrolidin-3-yl)boranuide
CID 169307385
CID 174084806
CID 174084806
Lithium hydrido(pyrrolidin-1-yl)borate(1-)
CID 23692626
(1-Ethylpyrrolidin-1-ium-1-yl)-trifluoroboranuide
CID 102079763
Trifluoro-(1-methylpyrrolidin-1-ium-1-yl)boranuide
CID 131031771
Trifluoro-(1-methylpyrrolidin-2-yl)boranuide
CID 147600458
Trifluoro-[(1-methylpyrrolidin-1-ium-1-yl)methyl]boranuide
CID 177598975

Frequently Asked Questions

What is the IUPAC name of difluoro(pyrrolidin-1-yl)borane?
The IUPAC name of difluoro(pyrrolidin-1-yl)borane (CID 134862692) is difluoro(pyrrolidin-1-yl)borane.
What is the SMILES notation for difluoro(pyrrolidin-1-yl)borane?
The canonical SMILES for difluoro(pyrrolidin-1-yl)borane is FB(F)N1CCCC1.
What is the InChIKey of difluoro(pyrrolidin-1-yl)borane?
The InChIKey is OUSZAPLFRGOKRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8BF2N/c6-5(7)8-3-1-2-4-8/h1-4H2.
What are the key properties of difluoro(pyrrolidin-1-yl)borane?
difluoro(pyrrolidin-1-yl)borane has a molecular weight of 118.92 g/mol, XLogP of 1.01, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for difluoro(pyrrolidin-1-yl)borane is sourced from PubChem (CID 134862692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).