carbon monoxide;[3-(3,4-dihydro-2H-pyran-6-yl)-1-methoxyprop-2-ynylidene]chromium

C14H10CrO7 — CID 11484635

IUPACcarbon monoxide;[3-(3,4-dihydro-2H-pyran-6-yl)-1-methoxyprop-2-ynylidene]chromium
SMILESCOC(=[Cr])C#CC1=CCCCO1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+]
InChIInChI=1S/C9H10O2.5CO.Cr/c1-10-7-4-6-9-5-2-3-8-11-9;5*1-2;/h5H,2-3,8H2,1H3;;;;;;
InChIKeyUZOKVRMGDPRQOJ-UHFFFAOYSA-N
MW342.22 g/mol
LogP0.82
Rot. Bonds1

About carbon monoxide;[3-(3,4-dihydro-2H-pyran-6-yl)-1-methoxyprop-2-ynylidene]chromium

carbon monoxide;[3-(3,4-dihydro-2H-pyran-6-yl)-1-methoxyprop-2-ynylidene]chromium (PubChem CID 11484635) has the molecular formula C14H10CrO7 and a molecular weight of 342.22 g/mol. Its IUPAC name is carbon monoxide;[3-(3,4-dihydro-2H-pyran-6-yl)-1-methoxyprop-2-ynylidene]chromium.

Molecular Properties

Compound Namecarbon monoxide;[3-(3,4-dihydro-2H-pyran-6-yl)-1-methoxyprop-2-ynylidene]chromium
PubChem CID11484635
Molecular FormulaC14H10CrO7
Molecular Weight342.22 g/mol
Exact Mass341.98
IUPAC Namecarbon monoxide;[3-(3,4-dihydro-2H-pyran-6-yl)-1-methoxyprop-2-ynylidene]chromium
SMILESCOC(=[Cr])C#CC1=CCCCO1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+]
InChIInChI=1S/C9H10O2.5CO.Cr/c1-10-7-4-6-9-5-2-3-8-11-9;5*1-2;/h5H,2-3,8H2,1H3;;;;;;
InChIKeyUZOKVRMGDPRQOJ-UHFFFAOYSA-N
XLogP0.82
TPSA117.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.22
LogP ≤ 50.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'charged_oxygen_or_sulfur_atoms', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

carbon monoxide;[3-(cyclopenten-1-yl)-1-methoxyprop-2-ynylidene]chromium
CID 10914365
[3-(cyclopenten-1-yl)-1-methoxyprop-2-ynylidene]chromium
CID 10914366
methyl 4-(3,4-dihydro-2H-pyran-6-yl)benzoate
CID 24938421
1-(3,4-dihydro-2H-pyran-6-yl)-2-(propan-2-ylamino)ethanone
CID 102648293
CID 11259646
CID 11259646
1-(3,4-dihydro-2H-pyran-6-yl)-2-[(2-methylpropan-2-yl)oxy]ethanone
CID 102648692
[1-(3,4-dihydro-2H-pyran-6-yl)-2-methoxy-2-methylpropyl]hydrazine
CID 102650063
lithium 3,4-dihydro-2H-pyran-6-yl(trimethyl)alumanuide
CID 135050678
sodium 3,4-dihydro-2H-pyran-6-yl-dimethyl-oxidosilane
CID 71306630
1-(3,4-dihydro-2H-pyran-6-yl)ethenol
CID 101235148
(E)-3-(3,4-dihydro-2H-pyran-6-yl)-3-methoxy-1-phenylprop-2-en-1-one
CID 135037853
1-(3,4-dihydro-2H-pyran-6-yl)-2-(3,4-dimethoxyphenyl)ethanol
CID 102649751

Frequently Asked Questions

What is the IUPAC name of carbon monoxide;[3-(3,4-dihydro-2H-pyran-6-yl)-1-methoxyprop-2-ynylidene]chromium?
The IUPAC name of carbon monoxide;[3-(3,4-dihydro-2H-pyran-6-yl)-1-methoxyprop-2-ynylidene]chromium (CID 11484635) is carbon monoxide;[3-(3,4-dihydro-2H-pyran-6-yl)-1-methoxyprop-2-ynylidene]chromium.
What is the SMILES notation for carbon monoxide;[3-(3,4-dihydro-2H-pyran-6-yl)-1-methoxyprop-2-ynylidene]chromium?
The canonical SMILES for carbon monoxide;[3-(3,4-dihydro-2H-pyran-6-yl)-1-methoxyprop-2-ynylidene]chromium is COC(=[Cr])C#CC1=CCCCO1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].
What is the InChIKey of carbon monoxide;[3-(3,4-dihydro-2H-pyran-6-yl)-1-methoxyprop-2-ynylidene]chromium?
The InChIKey is UZOKVRMGDPRQOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10O2.5CO.Cr/c1-10-7-4-6-9-5-2-3-8-11-9;5*1-2;/h5H,2-3,8H2,1H3;;;;;;.
What are the key properties of carbon monoxide;[3-(3,4-dihydro-2H-pyran-6-yl)-1-methoxyprop-2-ynylidene]chromium?
carbon monoxide;[3-(3,4-dihydro-2H-pyran-6-yl)-1-methoxyprop-2-ynylidene]chromium has a molecular weight of 342.22 g/mol, XLogP of 0.82, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for carbon monoxide;[3-(3,4-dihydro-2H-pyran-6-yl)-1-methoxyprop-2-ynylidene]chromium is sourced from PubChem (CID 11484635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).