hept-1-ene;polane

C7H16Po — CID 173465915

IUPAChept-1-ene;polane
SMILESC=CCCCCC.[PoH2]
InChIInChI=1S/C7H14.Po.2H/c1-3-5-7-6-4-2;;;/h3H,1,4-7H2,2H3;;;
InChIKeyHAVLREODAHHOJX-UHFFFAOYSA-N
MW309.21 g/mol
LogP1.84
Rot. Bonds4

About hept-1-ene;polane

hept-1-ene;polane (PubChem CID 173465915) has the molecular formula C7H16Po and a molecular weight of 309.21 g/mol. Its IUPAC name is hept-1-ene;polane.

Molecular Properties

Compound Namehept-1-ene;polane
PubChem CID173465915
Molecular FormulaC7H16Po
Molecular Weight309.21 g/mol
Exact Mass309.11
IUPAC Namehept-1-ene;polane
SMILESC=CCCCCC.[PoH2]
InChIInChI=1S/C7H14.Po.2H/c1-3-5-7-6-4-2;;;/h3H,1,4-7H2,2H3;;;
InChIKeyHAVLREODAHHOJX-UHFFFAOYSA-N
XLogP1.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.21
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

non-1-ene
CID 141296734
hexane;octadec-1-ene
CID 175577514
octadeca-1,17-diene;tetradec-1-ene
CID 173070986
octadec-1-ene;tetradec-1-ene
CID 158470925
dec-1-ene;dodec-1-ene;tetradec-1-ene
CID 159177706
octadecane;octadec-1-ene
CID 162018238
dec-1-ene;ethene
CID 161044144
oct-1-ene;tetrahydrochloride
CID 172847494
oct-1-ene;hydrobromide
CID 88838560
dodec-1-ene;ethene
CID 158697165
tetrakis(but-1-ene);oct-1-ene
CID 158942238
azane;undec-1-ene;hydrobromide
CID 175982130

Frequently Asked Questions

What is the IUPAC name of hept-1-ene;polane?
The IUPAC name of hept-1-ene;polane (CID 173465915) is hept-1-ene;polane.
What is the SMILES notation for hept-1-ene;polane?
The canonical SMILES for hept-1-ene;polane is C=CCCCCC.[PoH2].
What is the InChIKey of hept-1-ene;polane?
The InChIKey is HAVLREODAHHOJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14.Po.2H/c1-3-5-7-6-4-2;;;/h3H,1,4-7H2,2H3;;;.
What are the key properties of hept-1-ene;polane?
hept-1-ene;polane has a molecular weight of 309.21 g/mol, XLogP of 1.84, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for hept-1-ene;polane is sourced from PubChem (CID 173465915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).