magnesium;1,3,5-tri(propan-2-yl)benzene;dibromide

C15H24Br2Mg — CID 175275405

IUPACmagnesium;1,3,5-tri(propan-2-yl)benzene;dibromide
SMILESCC(C)c1cc(C(C)C)cc(C(C)C)c1.[Br-].[Br-].[Mg+2]
InChIInChI=1S/C15H24.2BrH.Mg/c1-10(2)13-7-14(11(3)4)9-15(8-13)12(5)6;;;/h7-12H,1-6H3;2*1H;/q;;;+2/p-2
InChIKeyOSYLUHRAVHEEOA-UHFFFAOYSA-L
MW388.47 g/mol
LogP-1.32
Rot. Bonds3

About magnesium;1,3,5-tri(propan-2-yl)benzene;dibromide

magnesium;1,3,5-tri(propan-2-yl)benzene;dibromide (PubChem CID 175275405) has the molecular formula C15H24Br2Mg and a molecular weight of 388.47 g/mol. Its IUPAC name is magnesium;1,3,5-tri(propan-2-yl)benzene;dibromide.

Molecular Properties

Compound Namemagnesium;1,3,5-tri(propan-2-yl)benzene;dibromide
PubChem CID175275405
Molecular FormulaC15H24Br2Mg
Molecular Weight388.47 g/mol
Exact Mass386.01
IUPAC Namemagnesium;1,3,5-tri(propan-2-yl)benzene;dibromide
SMILESCC(C)c1cc(C(C)C)cc(C(C)C)c1.[Br-].[Br-].[Mg+2]
InChIInChI=1S/C15H24.2BrH.Mg/c1-10(2)13-7-14(11(3)4)9-15(8-13)12(5)6;;;/h7-12H,1-6H3;2*1H;/q;;;+2/p-2
InChIKeyOSYLUHRAVHEEOA-UHFFFAOYSA-L
XLogP-1.32
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 5-1.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

CID 175757661
CID 175757661
1-[1-[3,5-di(propan-2-yl)phenyl]ethenyl]-3,5-di(propan-2-yl)benzene
CID 173174943
chromium;1,3,5-tri(propan-2-yl)benzene;1,3,5-tri(propan-2-yl)cyclohexane
CID 11985997
1,3-diiodo-5-propan-2-ylbenzene
CID 86082350
3,5-di(propan-2-yl)benzoic acid
CID 11958988
CID 174967963
CID 174967963
1-(difluoromethyl)-3-fluoro-5-propan-2-ylbenzene
CID 118404669
[3,5-di(propan-2-yl)phenyl]phosphanium tetrafluoroborate
CID 161167553
1-ethylsulfanyl-3,5-di(propan-2-yl)benzene
CID 162469287
1,2,3-trichloro-5-propan-2-ylbenzene
CID 20811691
1,3-dimethyl-2,5-di(propan-2-yl)benzene
CID 59820900
1-(2-fluoroethyl)-3,5-di(propan-2-yl)benzene
CID 68591438

Frequently Asked Questions

What is the IUPAC name of magnesium;1,3,5-tri(propan-2-yl)benzene;dibromide?
The IUPAC name of magnesium;1,3,5-tri(propan-2-yl)benzene;dibromide (CID 175275405) is magnesium;1,3,5-tri(propan-2-yl)benzene;dibromide.
What is the SMILES notation for magnesium;1,3,5-tri(propan-2-yl)benzene;dibromide?
The canonical SMILES for magnesium;1,3,5-tri(propan-2-yl)benzene;dibromide is CC(C)c1cc(C(C)C)cc(C(C)C)c1.[Br-].[Br-].[Mg+2].
What is the InChIKey of magnesium;1,3,5-tri(propan-2-yl)benzene;dibromide?
The InChIKey is OSYLUHRAVHEEOA-UHFFFAOYSA-L. The full InChI is InChI=1S/C15H24.2BrH.Mg/c1-10(2)13-7-14(11(3)4)9-15(8-13)12(5)6;;;/h7-12H,1-6H3;2*1H;/q;;;+2/p-2.
What are the key properties of magnesium;1,3,5-tri(propan-2-yl)benzene;dibromide?
magnesium;1,3,5-tri(propan-2-yl)benzene;dibromide has a molecular weight of 388.47 g/mol, XLogP of -1.32, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;1,3,5-tri(propan-2-yl)benzene;dibromide is sourced from PubChem (CID 175275405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).