CID 87071664

CH2KO3Zr — CID 87071664

IUPAC—
SMILESO=C(O)O.[K].[Zr]
InChIInChI=1S/CH2O3.K.Zr/c2-1(3)4;;/h(H2,2,3,4);;
InChIKeyDHKIPJJAPHSULU-UHFFFAOYSA-N
MW192.35 g/mol
LogP-0.16
Rot. Bonds

About CID 87071664

CID 87071664 (PubChem CID 87071664) has the molecular formula CH2KO3Zr and a molecular weight of 192.35 g/mol.

Molecular Properties

Compound NameCID 87071664
PubChem CID87071664
Molecular FormulaCH2KO3Zr
Molecular Weight192.35 g/mol
Exact Mass190.87
IUPAC Name—
SMILESO=C(O)O.[K].[Zr]
InChIInChI=1S/CH2O3.K.Zr/c2-1(3)4;;/h(H2,2,3,4);;
InChIKeyDHKIPJJAPHSULU-UHFFFAOYSA-N
XLogP-0.16
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.35
LogP ≤ 5-0.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of CID 87071664?
The IUPAC name of CID 87071664 (CID 87071664) is not available.
What is the SMILES notation for CID 87071664?
The canonical SMILES for CID 87071664 is O=C(O)O.[K].[Zr].
What is the InChIKey of CID 87071664?
The InChIKey is DHKIPJJAPHSULU-UHFFFAOYSA-N. The full InChI is InChI=1S/CH2O3.K.Zr/c2-1(3)4;;/h(H2,2,3,4);;.
What are the key properties of CID 87071664?
CID 87071664 has a molecular weight of 192.35 g/mol, XLogP of -0.16, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 87071664 is sourced from PubChem (CID 87071664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).