magnesium;4-hexyl-2H-thiophen-2-ide;bromide;hydrochloride

C10H16BrClMgS — CID 89350736

IUPACmagnesium;4-hexyl-2H-thiophen-2-ide;bromide;hydrochloride
SMILESCCCCCCc1c[c-]sc1.Cl.[Br-].[Mg+2]
InChIInChI=1S/C10H15S.BrH.ClH.Mg/c1-2-3-4-5-6-10-7-8-11-9-10;;;/h7,9H,2-6H2,1H3;2*1H;/q-1;;;+2/p-1
InChIKeyNYVGFGRDVLPDCF-UHFFFAOYSA-M
MW307.97 g/mol
LogP0.72
Rot. Bonds5

About magnesium;4-hexyl-2H-thiophen-2-ide;bromide;hydrochloride

magnesium;4-hexyl-2H-thiophen-2-ide;bromide;hydrochloride (PubChem CID 89350736) has the molecular formula C10H16BrClMgS and a molecular weight of 307.97 g/mol. Its IUPAC name is magnesium;4-hexyl-2H-thiophen-2-ide;bromide;hydrochloride.

Molecular Properties

Compound Namemagnesium;4-hexyl-2H-thiophen-2-ide;bromide;hydrochloride
PubChem CID89350736
Molecular FormulaC10H16BrClMgS
Molecular Weight307.97 g/mol
Exact Mass305.97
IUPAC Namemagnesium;4-hexyl-2H-thiophen-2-ide;bromide;hydrochloride
SMILESCCCCCCc1c[c-]sc1.Cl.[Br-].[Mg+2]
InChIInChI=1S/C10H15S.BrH.ClH.Mg/c1-2-3-4-5-6-10-7-8-11-9-10;;;/h7,9H,2-6H2,1H3;2*1H;/q-1;;;+2/p-1
InChIKeyNYVGFGRDVLPDCF-UHFFFAOYSA-M
XLogP0.72
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.97
LogP ≤ 50.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Magnesium bromide 3-hexylthiophen-2-ide (1/1/1)
CID 71358086
4-Hexyl-2-thienyllithium
CID 85970345
1-Ethenylidene-3-hexylthiophene
CID 91359807
magnesium;3-decyl-2H-thiophen-2-ide;bromide
CID 134947511
magnesium;3,4-dibutyl-2H-thiophen-2-ide;bromide
CID 135077309
chlorozinc(1+);3-octyl-2H-thiophen-2-ide
CID 58807315
(3-Octylthiophen-2-yl)magnesium bromide
CID 59482905
magnesium;3-dodecyl-2H-thiophen-2-ide;bromide
CID 87523427
1,1-Dibromo-3-octylthiophene
CID 141270735
bromozinc(1+);4-hexyl-2H-thiophen-2-ide;hydrobromide
CID 174728201
chlorozinc(1+);4-dodecyl-2H-thiophen-2-ide
CID 11727877
chlorozinc(1+);4-dodecyl-3H-thiophen-3-ide
CID 15977151

Frequently Asked Questions

What is the IUPAC name of magnesium;4-hexyl-2H-thiophen-2-ide;bromide;hydrochloride?
The IUPAC name of magnesium;4-hexyl-2H-thiophen-2-ide;bromide;hydrochloride (CID 89350736) is magnesium;4-hexyl-2H-thiophen-2-ide;bromide;hydrochloride.
What is the SMILES notation for magnesium;4-hexyl-2H-thiophen-2-ide;bromide;hydrochloride?
The canonical SMILES for magnesium;4-hexyl-2H-thiophen-2-ide;bromide;hydrochloride is CCCCCCc1c[c-]sc1.Cl.[Br-].[Mg+2].
What is the InChIKey of magnesium;4-hexyl-2H-thiophen-2-ide;bromide;hydrochloride?
The InChIKey is NYVGFGRDVLPDCF-UHFFFAOYSA-M. The full InChI is InChI=1S/C10H15S.BrH.ClH.Mg/c1-2-3-4-5-6-10-7-8-11-9-10;;;/h7,9H,2-6H2,1H3;2*1H;/q-1;;;+2/p-1.
What are the key properties of magnesium;4-hexyl-2H-thiophen-2-ide;bromide;hydrochloride?
magnesium;4-hexyl-2H-thiophen-2-ide;bromide;hydrochloride has a molecular weight of 307.97 g/mol, XLogP of 0.72, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;4-hexyl-2H-thiophen-2-ide;bromide;hydrochloride is sourced from PubChem (CID 89350736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).