CID 58943019

C3H8LiNbO — CID 58943019

IUPAC—
SMILESCC(C)O.[Li].[Nb]
InChIInChI=1S/C3H8O.Li.Nb/c1-3(2)4;;/h3-4H,1-2H3;;
InChIKeyALOMBGPNYSDJHJ-UHFFFAOYSA-N
MW159.94 g/mol
LogP0.00
Rot. Bonds

About CID 58943019

CID 58943019 (PubChem CID 58943019) has the molecular formula C3H8LiNbO and a molecular weight of 159.94 g/mol.

Molecular Properties

Compound NameCID 58943019
PubChem CID58943019
Molecular FormulaC3H8LiNbO
Molecular Weight159.94 g/mol
Exact Mass159.98
IUPAC Name—
SMILESCC(C)O.[Li].[Nb]
InChIInChI=1S/C3H8O.Li.Nb/c1-3(2)4;;/h3-4H,1-2H3;;
InChIKeyALOMBGPNYSDJHJ-UHFFFAOYSA-N
XLogP0.00
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.94
LogP ≤ 50.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

Isopropanol
CID 3776
(O,1,1,1,2,3,3,3-2H8)propan-2-ol
CID 2723972
Propan-2-[2H]ol
CID 520960
2-Propan-2-d-ol
CID 12213344
2-Propanol-1,1,1,3,3,3-d6
CID 12213346
2-Propanol-1,1,1-d3
CID 12213345
Isopropanol-d7
CID 12213347
2-Propanol-2-13C
CID 16213337
(~13~C_3_)Propan-2-ol
CID 71309146
(1,3-~13~C_2_)Propan-2-ol
CID 71309419
Propan-2-(~17~O)ol
CID 71309655
Cerium (IV) isopropoxide
CID 73877431

Frequently Asked Questions

What is the IUPAC name of CID 58943019?
The IUPAC name of CID 58943019 (CID 58943019) is not available.
What is the SMILES notation for CID 58943019?
The canonical SMILES for CID 58943019 is CC(C)O.[Li].[Nb].
What is the InChIKey of CID 58943019?
The InChIKey is ALOMBGPNYSDJHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8O.Li.Nb/c1-3(2)4;;/h3-4H,1-2H3;;.
What are the key properties of CID 58943019?
CID 58943019 has a molecular weight of 159.94 g/mol, XLogP of 0.00, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 58943019 is sourced from PubChem (CID 58943019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).