chromium;bis(4-methylphenol);chloride

C14H16ClCrO2- — CID 172752271

IUPACchromium;bis(4-methylphenol);chloride
SMILESCc1ccc(O)cc1.Cc1ccc(O)cc1.[Cl-].[Cr]
InChIInChI=1S/2C7H8O.ClH.Cr/c2*1-6-2-4-7(8)5-3-6;;/h2*2-5,8H,1H3;1H;/p-1
InChIKeyQHTPPSMDCJFMCB-UHFFFAOYSA-M
MW303.73 g/mol
LogP0.40
Rot. Bonds

About chromium;bis(4-methylphenol);chloride

chromium;bis(4-methylphenol);chloride (PubChem CID 172752271) has the molecular formula C14H16ClCrO2- and a molecular weight of 303.73 g/mol. Its IUPAC name is chromium;bis(4-methylphenol);chloride.

Molecular Properties

Compound Namechromium;bis(4-methylphenol);chloride
PubChem CID172752271
Molecular FormulaC14H16ClCrO2-
Molecular Weight303.73 g/mol
Exact Mass303.02
IUPAC Namechromium;bis(4-methylphenol);chloride
SMILESCc1ccc(O)cc1.Cc1ccc(O)cc1.[Cl-].[Cr]
InChIInChI=1S/2C7H8O.ClH.Cr/c2*1-6-2-4-7(8)5-3-6;;/h2*2-5,8H,1H3;1H;/p-1
InChIKeyQHTPPSMDCJFMCB-UHFFFAOYSA-M
XLogP0.40
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.73
LogP ≤ 50.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-methylphenol
CID 70549076
bis(4-methylphenol);tetrahydrochloride
CID 175346853
4-methylphenol;hydrate
CID 71777661
4-methylphenol;2-methylpropane
CID 91606636
ethane;4-(4-methylphenyl)phenol
CID 161379556
boric acid;4-methylphenol
CID 67912006
dichlorotungsten;tris(4-methylphenol);hydrate
CID 153466835
4-methylphenol;prop-1-yne
CID 158792009
4-methylphenol;propan-2-ylphosphane
CID 144779899
ethane;methylbenzene;4-methylphenol;yttrium
CID 160854018
azane;aziridin-2-one;4-methylphenol
CID 88801841
ethane;formic acid;4-methylphenol
CID 143673297

Frequently Asked Questions

What is the IUPAC name of chromium;bis(4-methylphenol);chloride?
The IUPAC name of chromium;bis(4-methylphenol);chloride (CID 172752271) is chromium;bis(4-methylphenol);chloride.
What is the SMILES notation for chromium;bis(4-methylphenol);chloride?
The canonical SMILES for chromium;bis(4-methylphenol);chloride is Cc1ccc(O)cc1.Cc1ccc(O)cc1.[Cl-].[Cr].
What is the InChIKey of chromium;bis(4-methylphenol);chloride?
The InChIKey is QHTPPSMDCJFMCB-UHFFFAOYSA-M. The full InChI is InChI=1S/2C7H8O.ClH.Cr/c2*1-6-2-4-7(8)5-3-6;;/h2*2-5,8H,1H3;1H;/p-1.
What are the key properties of chromium;bis(4-methylphenol);chloride?
chromium;bis(4-methylphenol);chloride has a molecular weight of 303.73 g/mol, XLogP of 0.40, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for chromium;bis(4-methylphenol);chloride is sourced from PubChem (CID 172752271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).