9-heptylheptadecan-8-ylsilane

C24H52Si — CID 123598466

IUPAC9-heptylheptadecan-8-ylsilane
SMILESCCCCCCCCC(CCCCCCC)C([SiH3])CCCCCCC
InChIInChI=1S/C24H52Si/c1-4-7-10-13-16-18-21-23(20-17-14-11-8-5-2)24(25)22-19-15-12-9-6-3/h23-24H,4-22H2,1-3,25H3
InChIKeyPXFNKQCQRYZDRG-UHFFFAOYSA-N
MW368.77 g/mol
LogP8.23
Rot. Bonds20

About 9-heptylheptadecan-8-ylsilane

9-heptylheptadecan-8-ylsilane (PubChem CID 123598466) has the molecular formula C24H52Si and a molecular weight of 368.77 g/mol. Its IUPAC name is 9-heptylheptadecan-8-ylsilane.

Molecular Properties

Compound Name9-heptylheptadecan-8-ylsilane
PubChem CID123598466
Molecular FormulaC24H52Si
Molecular Weight368.77 g/mol
Exact Mass368.38
IUPAC Name9-heptylheptadecan-8-ylsilane
SMILESCCCCCCCCC(CCCCCCC)C([SiH3])CCCCCCC
InChIInChI=1S/C24H52Si/c1-4-7-10-13-16-18-21-23(20-17-14-11-8-5-2)24(25)22-19-15-12-9-6-3/h23-24H,4-22H2,1-3,25H3
InChIKeyPXFNKQCQRYZDRG-UHFFFAOYSA-N
XLogP8.23
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds20
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.77
LogP ≤ 58.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

9,10-dioctylhexacosane
CID 21470284
7,8-dihexylicosane
CID 21490611
8,9-dibutylhexadecane
CID 530025
4,5-dipropyltetradecane
CID 21490606
8-hexyl-7-propyltriacontane
CID 21490607
9,10-diethyloctadecane
CID 530164
octadecan-9-ylsilane
CID 123535784
11-octadecan-9-yl-10,12-dioctylhenicosane
CID 91046537
7,8-dipropyltetradecane
CID 530307
19-heptadecan-3-ylnonatriacontane
CID 57212477
6-ethyl-7-pentyltetradecane
CID 123140274
5,6-diethyldodecane
CID 90761715

Frequently Asked Questions

What is the IUPAC name of 9-heptylheptadecan-8-ylsilane?
The IUPAC name of 9-heptylheptadecan-8-ylsilane (CID 123598466) is 9-heptylheptadecan-8-ylsilane.
What is the SMILES notation for 9-heptylheptadecan-8-ylsilane?
The canonical SMILES for 9-heptylheptadecan-8-ylsilane is CCCCCCCCC(CCCCCCC)C([SiH3])CCCCCCC.
What is the InChIKey of 9-heptylheptadecan-8-ylsilane?
The InChIKey is PXFNKQCQRYZDRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H52Si/c1-4-7-10-13-16-18-21-23(20-17-14-11-8-5-2)24(25)22-19-15-12-9-6-3/h23-24H,4-22H2,1-3,25H3.
What are the key properties of 9-heptylheptadecan-8-ylsilane?
9-heptylheptadecan-8-ylsilane has a molecular weight of 368.77 g/mol, XLogP of 8.23, 20 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-heptylheptadecan-8-ylsilane is sourced from PubChem (CID 123598466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).