dichloromolybdenum;oxolane

C4H8Cl2MoO — CID 134888585

IUPACdichloromolybdenum;oxolane
SMILESC1CCOC1.Cl[Mo]Cl
InChIInChI=1S/C4H8O.2ClH.Mo/c1-2-4-5-3-1;;;/h1-4H2;2*1H;/q;;;+2/p-2
InChIKeySDVKMVLOOZGRAX-UHFFFAOYSA-L
MW238.95 g/mol
LogP2.17
Rot. Bonds

About dichloromolybdenum;oxolane

dichloromolybdenum;oxolane (PubChem CID 134888585) has the molecular formula C4H8Cl2MoO and a molecular weight of 238.95 g/mol. Its IUPAC name is dichloromolybdenum;oxolane.

Molecular Properties

Compound Namedichloromolybdenum;oxolane
PubChem CID134888585
Molecular FormulaC4H8Cl2MoO
Molecular Weight238.95 g/mol
Exact Mass239.90
IUPAC Namedichloromolybdenum;oxolane
SMILESC1CCOC1.Cl[Mo]Cl
InChIInChI=1S/C4H8O.2ClH.Mo/c1-2-4-5-3-1;;;/h1-4H2;2*1H;/q;;;+2/p-2
InChIKeySDVKMVLOOZGRAX-UHFFFAOYSA-L
XLogP2.17
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.95
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of dichloromolybdenum;oxolane?
The IUPAC name of dichloromolybdenum;oxolane (CID 134888585) is dichloromolybdenum;oxolane.
What is the SMILES notation for dichloromolybdenum;oxolane?
The canonical SMILES for dichloromolybdenum;oxolane is C1CCOC1.Cl[Mo]Cl.
What is the InChIKey of dichloromolybdenum;oxolane?
The InChIKey is SDVKMVLOOZGRAX-UHFFFAOYSA-L. The full InChI is InChI=1S/C4H8O.2ClH.Mo/c1-2-4-5-3-1;;;/h1-4H2;2*1H;/q;;;+2/p-2.
What are the key properties of dichloromolybdenum;oxolane?
dichloromolybdenum;oxolane has a molecular weight of 238.95 g/mol, XLogP of 2.17, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dichloromolybdenum;oxolane is sourced from PubChem (CID 134888585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).