non-8-enylperoxy formate

C10H18O4 — CID 140843638

IUPACnon-8-enylperoxy formate
SMILESC=CCCCCCCCOOOC=O
InChIInChI=1S/C10H18O4/c1-2-3-4-5-6-7-8-9-12-14-13-10-11/h2,10H,1,3-9H2
InChIKeyRCKMBPVOMQMXTE-UHFFFAOYSA-N
MW202.25 g/mol
LogP2.55
Rot. Bonds11

About non-8-enylperoxy formate

non-8-enylperoxy formate (PubChem CID 140843638) has the molecular formula C10H18O4 and a molecular weight of 202.25 g/mol. Its IUPAC name is non-8-enylperoxy formate.

Molecular Properties

Compound Namenon-8-enylperoxy formate
PubChem CID140843638
Molecular FormulaC10H18O4
Molecular Weight202.25 g/mol
Exact Mass202.12
IUPAC Namenon-8-enylperoxy formate
SMILESC=CCCCCCCCOOOC=O
InChIInChI=1S/C10H18O4/c1-2-3-4-5-6-7-8-9-12-14-13-10-11/h2,10H,1,3-9H2
InChIKeyRCKMBPVOMQMXTE-UHFFFAOYSA-N
XLogP2.55
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.25
LogP ≤ 52.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

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Related Compounds

7-(trioxidanyl)hept-1-ene
CID 90829366
12-dodec-11-enoxydodec-1-ene
CID 87325659
heptacosa-1,26-diene
CID 58905535
heptadeca-1,16-diene
CID 6429392
tridec-12-enal
CID 57284057
henicos-20-enal
CID 14559831
bis(dec-9-enyl) (Z)-but-2-enedioate
CID 86753272
11-(2-ethoxyethoxy)undec-1-ene
CID 142718569
11-[2-(2-ethoxyethoxy)ethoxy]undec-1-ene
CID 142718592
2-[2-[2-(2-undec-10-enoxyethoxy)ethoxy]ethoxy]acetic acid
CID 45275900
hex-5-enoxysilane
CID 123933799
hexadec-15-enyl carbonochloridate
CID 139984771

Frequently Asked Questions

What is the IUPAC name of non-8-enylperoxy formate?
The IUPAC name of non-8-enylperoxy formate (CID 140843638) is non-8-enylperoxy formate.
What is the SMILES notation for non-8-enylperoxy formate?
The canonical SMILES for non-8-enylperoxy formate is C=CCCCCCCCOOOC=O.
What is the InChIKey of non-8-enylperoxy formate?
The InChIKey is RCKMBPVOMQMXTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O4/c1-2-3-4-5-6-7-8-9-12-14-13-10-11/h2,10H,1,3-9H2.
What are the key properties of non-8-enylperoxy formate?
non-8-enylperoxy formate has a molecular weight of 202.25 g/mol, XLogP of 2.55, 11 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for non-8-enylperoxy formate is sourced from PubChem (CID 140843638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).