33-[dichloro(methyl)silyl]tritriacontan-1-amine

C34H71Cl2NSi — CID 87684387

IUPAC33-[dichloro(methyl)silyl]tritriacontan-1-amine
SMILESC[Si](Cl)(Cl)CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCN
InChIInChI=1S/C34H71Cl2NSi/c1-38(35,36)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-37/h2-34,37H2,1H3
InChIKeyMNZYTSHCVQMDCE-UHFFFAOYSA-N
MW592.94 g/mol
LogP13.59
Rot. Bonds33

About 33-[dichloro(methyl)silyl]tritriacontan-1-amine

33-[dichloro(methyl)silyl]tritriacontan-1-amine (PubChem CID 87684387) has the molecular formula C34H71Cl2NSi and a molecular weight of 592.94 g/mol. Its IUPAC name is 33-[dichloro(methyl)silyl]tritriacontan-1-amine.

Molecular Properties

Compound Name33-[dichloro(methyl)silyl]tritriacontan-1-amine
PubChem CID87684387
Molecular FormulaC34H71Cl2NSi
Molecular Weight592.94 g/mol
Exact Mass591.47
IUPAC Name33-[dichloro(methyl)silyl]tritriacontan-1-amine
SMILESC[Si](Cl)(Cl)CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCN
InChIInChI=1S/C34H71Cl2NSi/c1-38(35,36)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-37/h2-34,37H2,1H3
InChIKeyMNZYTSHCVQMDCE-UHFFFAOYSA-N
XLogP13.59
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds33
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500592.94
LogP ≤ 513.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'}

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Related Compounds

dichloro-[5-[dichloro(methyl)silyl]pentyl]-methylsilane
CID 154317252
38-trichlorosilyloctatriacontan-1-amine
CID 87683970
4-trichlorosilylbutan-1-amine
CID 54147882
9-[dichloro(methyl)silyl]nonane-1-thiol
CID 87681480
14-bromotetradecyl-dichloro-methylsilane
CID 87684527
38-[dichloro(methyl)silyl]octatriacontane-1-thiol
CID 87684171
9-bromononyl-dichloro-methylsilane
CID 87683387
11-[dichloro(methyl)silyl]undecan-1-ol
CID 87682607
6-[dichloro(methyl)silyl]hexan-1-ol
CID 87686443
4-[dihydroxy(methyl)silyl]butan-1-amine
CID 147482092
36-trimethoxysilylhexatriacontan-1-amine
CID 87680936
33-trimethoxysilyltritriacontan-1-amine
CID 87686996

Frequently Asked Questions

What is the IUPAC name of 33-[dichloro(methyl)silyl]tritriacontan-1-amine?
The IUPAC name of 33-[dichloro(methyl)silyl]tritriacontan-1-amine (CID 87684387) is 33-[dichloro(methyl)silyl]tritriacontan-1-amine.
What is the SMILES notation for 33-[dichloro(methyl)silyl]tritriacontan-1-amine?
The canonical SMILES for 33-[dichloro(methyl)silyl]tritriacontan-1-amine is C[Si](Cl)(Cl)CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCN.
What is the InChIKey of 33-[dichloro(methyl)silyl]tritriacontan-1-amine?
The InChIKey is MNZYTSHCVQMDCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H71Cl2NSi/c1-38(35,36)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-37/h2-34,37H2,1H3.
What are the key properties of 33-[dichloro(methyl)silyl]tritriacontan-1-amine?
33-[dichloro(methyl)silyl]tritriacontan-1-amine has a molecular weight of 592.94 g/mol, XLogP of 13.59, 33 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 33-[dichloro(methyl)silyl]tritriacontan-1-amine is sourced from PubChem (CID 87684387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).