chromium;formaldehyde;1,3,5-trimethylbenzene

C12H18CrO3 — CID 15823960

IUPACchromium;formaldehyde;1,3,5-trimethylbenzene
SMILESC=O.C=O.C=O.Cc1cc(C)cc(C)c1.[Cr]
InChIInChI=1S/C9H12.3CH2O.Cr/c1-7-4-8(2)6-9(3)5-7;3*1-2;/h4-6H,1-3H3;3*1H2;
InChIKeyFKKJUQOQQXSXSA-UHFFFAOYSA-N
MW262.27 g/mol
LogP2.05
Rot. Bonds

About chromium;formaldehyde;1,3,5-trimethylbenzene

chromium;formaldehyde;1,3,5-trimethylbenzene (PubChem CID 15823960) has the molecular formula C12H18CrO3 and a molecular weight of 262.27 g/mol. Its IUPAC name is chromium;formaldehyde;1,3,5-trimethylbenzene.

Molecular Properties

Compound Namechromium;formaldehyde;1,3,5-trimethylbenzene
PubChem CID15823960
Molecular FormulaC12H18CrO3
Molecular Weight262.27 g/mol
Exact Mass262.07
IUPAC Namechromium;formaldehyde;1,3,5-trimethylbenzene
SMILESC=O.C=O.C=O.Cc1cc(C)cc(C)c1.[Cr]
InChIInChI=1S/C9H12.3CH2O.Cr/c1-7-4-8(2)6-9(3)5-7;3*1-2;/h4-6H,1-3H3;3*1H2;
InChIKeyFKKJUQOQQXSXSA-UHFFFAOYSA-N
XLogP2.05
TPSA51.21 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.27
LogP ≤ 52.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

M-Xylene
CID 7929
Mesitylene
CID 7947
1-Ethenyl-3-methylbenzene
CID 7529
5-Ethyl-m-xylene
CID 13627
3,5-Dimethylstyrene
CID 21476
3,5-Diethyltoluene
CID 16302
1,3,5-Triethylbenzene
CID 7602
2,4,6-Trimethylbenzeneboronic acid
CID 292184
Tricarbonyl[(1,2,3,4,5,6-eta)-1,3,5-trimethylbenzene]tungsten
CID 10981963
Tricarbonyl[(1,2,3,4,5,6-eta)-1,3,5-trimethylbenzene]chromium
CID 11107945
Benzene, m-dibutyl-
CID 204985
1,3-Dipropylbenzene
CID 519365

Frequently Asked Questions

What is the IUPAC name of chromium;formaldehyde;1,3,5-trimethylbenzene?
The IUPAC name of chromium;formaldehyde;1,3,5-trimethylbenzene (CID 15823960) is chromium;formaldehyde;1,3,5-trimethylbenzene.
What is the SMILES notation for chromium;formaldehyde;1,3,5-trimethylbenzene?
The canonical SMILES for chromium;formaldehyde;1,3,5-trimethylbenzene is C=O.C=O.C=O.Cc1cc(C)cc(C)c1.[Cr].
What is the InChIKey of chromium;formaldehyde;1,3,5-trimethylbenzene?
The InChIKey is FKKJUQOQQXSXSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12.3CH2O.Cr/c1-7-4-8(2)6-9(3)5-7;3*1-2;/h4-6H,1-3H3;3*1H2;.
What are the key properties of chromium;formaldehyde;1,3,5-trimethylbenzene?
chromium;formaldehyde;1,3,5-trimethylbenzene has a molecular weight of 262.27 g/mol, XLogP of 2.05, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for chromium;formaldehyde;1,3,5-trimethylbenzene is sourced from PubChem (CID 15823960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).