magnesium;pentadecane;chloride

C15H31ClMg — CID 88592756

IUPACmagnesium;pentadecane;chloride
SMILES[CH2-]CCCCCCCCCCCCCC.[Cl-].[Mg+2]
InChIInChI=1S/C15H31.ClH.Mg/c1-3-5-7-9-11-13-15-14-12-10-8-6-4-2;;/h1,3-15H2,2H3;1H;/q-1;;+2/p-1
InChIKeyYZWBUWJHNRVUOH-UHFFFAOYSA-M
MW271.17 g/mol
LogP2.53
Rot. Bonds12

About magnesium;pentadecane;chloride

magnesium;pentadecane;chloride (PubChem CID 88592756) has the molecular formula C15H31ClMg and a molecular weight of 271.17 g/mol. Its IUPAC name is magnesium;pentadecane;chloride.

Molecular Properties

Compound Namemagnesium;pentadecane;chloride
PubChem CID88592756
Molecular FormulaC15H31ClMg
Molecular Weight271.17 g/mol
Exact Mass270.20
IUPAC Namemagnesium;pentadecane;chloride
SMILES[CH2-]CCCCCCCCCCCCCC.[Cl-].[Mg+2]
InChIInChI=1S/C15H31.ClH.Mg/c1-3-5-7-9-11-13-15-14-12-10-8-6-4-2;;/h1,3-15H2,2H3;1H;/q-1;;+2/p-1
InChIKeyYZWBUWJHNRVUOH-UHFFFAOYSA-M
XLogP2.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds12
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.17
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze magnesium;pentadecane;chloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

magnesium;octane;propane
CID 140617216
magnesium;octadecane;bromide
CID 12546206
CID 158218967
CID 158218967
heptadecane
CID 156905849
magnesium;butane;octane;hydrochloride
CID 87898861
magnesium;octane;propane
CID 140617215
tetrakis(dodecane);zirconium(4+)
CID 173426195
bis(hexane);hexane;propane;yttrium
CID 160746631
cerium;dodecane
CID 154114371
zinc heptane
CID 4204916
dodecane;zirconium
CID 148549415
magnesium;hexane;pentane
CID 19799394

Frequently Asked Questions

What is the IUPAC name of magnesium;pentadecane;chloride?
The IUPAC name of magnesium;pentadecane;chloride (CID 88592756) is magnesium;pentadecane;chloride.
What is the SMILES notation for magnesium;pentadecane;chloride?
The canonical SMILES for magnesium;pentadecane;chloride is [CH2-]CCCCCCCCCCCCCC.[Cl-].[Mg+2].
What is the InChIKey of magnesium;pentadecane;chloride?
The InChIKey is YZWBUWJHNRVUOH-UHFFFAOYSA-M. The full InChI is InChI=1S/C15H31.ClH.Mg/c1-3-5-7-9-11-13-15-14-12-10-8-6-4-2;;/h1,3-15H2,2H3;1H;/q-1;;+2/p-1.
What are the key properties of magnesium;pentadecane;chloride?
magnesium;pentadecane;chloride has a molecular weight of 271.17 g/mol, XLogP of 2.53, 12 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;pentadecane;chloride is sourced from PubChem (CID 88592756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).