4H-chromene;manganese

C9H8MnO — CID 67107670

IUPAC4H-chromene;manganese
SMILESC1=COc2ccccc2C1.[Mn]
InChIInChI=1S/C9H8O.Mn/c1-2-6-9-8(4-1)5-3-7-10-9;/h1-4,6-7H,5H2;
InChIKeyMWXAWSWZIKKKGN-UHFFFAOYSA-N
MW187.10 g/mol
LogP2.13
Rot. Bonds

About 4H-chromene;manganese

4H-chromene;manganese (PubChem CID 67107670) has the molecular formula C9H8MnO and a molecular weight of 187.10 g/mol. Its IUPAC name is 4H-chromene;manganese.

Molecular Properties

Compound Name4H-chromene;manganese
PubChem CID67107670
Molecular FormulaC9H8MnO
Molecular Weight187.10 g/mol
Exact Mass187.00
IUPAC Name4H-chromene;manganese
SMILESC1=COc2ccccc2C1.[Mn]
InChIInChI=1S/C9H8O.Mn/c1-2-6-9-8(4-1)5-3-7-10-9;/h1-4,6-7H,5H2;
InChIKeyMWXAWSWZIKKKGN-UHFFFAOYSA-N
XLogP2.13
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.10
LogP ≤ 52.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4H-chromene;manganese?
The IUPAC name of 4H-chromene;manganese (CID 67107670) is 4H-chromene;manganese.
What is the SMILES notation for 4H-chromene;manganese?
The canonical SMILES for 4H-chromene;manganese is C1=COc2ccccc2C1.[Mn].
What is the InChIKey of 4H-chromene;manganese?
The InChIKey is MWXAWSWZIKKKGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8O.Mn/c1-2-6-9-8(4-1)5-3-7-10-9;/h1-4,6-7H,5H2;.
What are the key properties of 4H-chromene;manganese?
4H-chromene;manganese has a molecular weight of 187.10 g/mol, XLogP of 2.13, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4H-chromene;manganese is sourced from PubChem (CID 67107670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).