CID 153398421

C8H18NO3Se — CID 153398421

IUPAC—
SMILESCCOCCOCCOCCN[Se]
InChIInChI=1S/C8H18NO3Se/c1-2-10-5-6-12-8-7-11-4-3-9-13/h9H,2-8H2,1H3
InChIKeyGGOBLKWHESDUGO-UHFFFAOYSA-N
MW255.20 g/mol
LogP-0.27
Rot. Bonds10

About CID 153398421

CID 153398421 (PubChem CID 153398421) has the molecular formula C8H18NO3Se and a molecular weight of 255.20 g/mol.

Molecular Properties

Compound NameCID 153398421
PubChem CID153398421
Molecular FormulaC8H18NO3Se
Molecular Weight255.20 g/mol
Exact Mass256.05
IUPAC Name—
SMILESCCOCCOCCOCCN[Se]
InChIInChI=1S/C8H18NO3Se/c1-2-10-5-6-12-8-7-11-4-3-9-13/h9H,2-8H2,1H3
InChIKeyGGOBLKWHESDUGO-UHFFFAOYSA-N
XLogP-0.27
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.20
LogP ≤ 5-0.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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

N-[2-(2-ethoxyethoxy)ethyl]-2-methoxyethanamine
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1,2-diethoxyethane;hydrofluoride
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4-ethoxy-N-[2-(2-ethoxyethoxy)ethyl]butan-1-amine
CID 62565012
1-[2-[2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propane
CID 88861501
N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-2,2-dimethylpropan-1-amine
CID 138727338
N-[2-(2-ethoxyethoxy)ethyl]methanesulfonamide
CID 176560121
N-[2-(2-ethoxyethoxy)ethyl]butan-2-amine
CID 62565963
sodium;1,2-diethoxyethane;hydride
CID 174903036
1,2-diethoxyethane;ethene
CID 158825770
N-[2-(2-ethoxyethoxy)ethyl]-3-methoxypropan-1-amine
CID 62565586
N-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]propanamide
CID 122664379
1-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]-2-methoxyethane
CID 19982973

Frequently Asked Questions

What is the IUPAC name of CID 153398421?
The IUPAC name of CID 153398421 (CID 153398421) is not available.
What is the SMILES notation for CID 153398421?
The canonical SMILES for CID 153398421 is CCOCCOCCOCCN[Se].
What is the InChIKey of CID 153398421?
The InChIKey is GGOBLKWHESDUGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18NO3Se/c1-2-10-5-6-12-8-7-11-4-3-9-13/h9H,2-8H2,1H3.
What are the key properties of CID 153398421?
CID 153398421 has a molecular weight of 255.20 g/mol, XLogP of -0.27, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 153398421 is sourced from PubChem (CID 153398421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).