butan-1-ol;nickel

C4H10NiO — CID 22477011

IUPACbutan-1-ol;nickel
SMILESCCCCO.[Ni]
InChIInChI=1S/C4H10O.Ni/c1-2-3-4-5;/h5H,2-4H2,1H3;
InChIKeyHJZSDLYTQYGTMC-UHFFFAOYSA-N
MW132.82 g/mol
LogP0.78
Rot. Bonds2

About butan-1-ol;nickel

butan-1-ol;nickel (PubChem CID 22477011) has the molecular formula C4H10NiO and a molecular weight of 132.82 g/mol. Its IUPAC name is butan-1-ol;nickel.

Molecular Properties

Compound Namebutan-1-ol;nickel
PubChem CID22477011
Molecular FormulaC4H10NiO
Molecular Weight132.82 g/mol
Exact Mass132.01
IUPAC Namebutan-1-ol;nickel
SMILESCCCCO.[Ni]
InChIInChI=1S/C4H10O.Ni/c1-2-3-4-5;/h5H,2-4H2,1H3;
InChIKeyHJZSDLYTQYGTMC-UHFFFAOYSA-N
XLogP0.78
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.82
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

butan-1-ol
CID 20532113
(1,2,3,4-13C4)butan-1-ol
CID 71309697
sodium butan-1-ol
CID 19366054
butane;butan-1-ol
CID 19774960
tris(butan-1-ol);zirconium
CID 25200102
butan-1-ol;cadmium
CID 154199105
butan-1-ol;methanol
CID 23065762
butan-1-ol;plumbane
CID 173408910
tetrakis(butan-1-ol);cerium
CID 87109841
pentakis(butan-1-ol);vanadium
CID 14228635
tris(butan-1-ol);propane;titanium
CID 150243103
tetrakis(butan-1-ol);propane;titanium
CID 174520119

Frequently Asked Questions

What is the IUPAC name of butan-1-ol;nickel?
The IUPAC name of butan-1-ol;nickel (CID 22477011) is butan-1-ol;nickel.
What is the SMILES notation for butan-1-ol;nickel?
The canonical SMILES for butan-1-ol;nickel is CCCCO.[Ni].
What is the InChIKey of butan-1-ol;nickel?
The InChIKey is HJZSDLYTQYGTMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10O.Ni/c1-2-3-4-5;/h5H,2-4H2,1H3;.
What are the key properties of butan-1-ol;nickel?
butan-1-ol;nickel has a molecular weight of 132.82 g/mol, XLogP of 0.78, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for butan-1-ol;nickel is sourced from PubChem (CID 22477011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).