[(Z)-non-7-en-3-yl] formate

C10H18O2 — CID 87470057

IUPAC[(Z)-non-7-en-3-yl] formate
SMILESC/C=C\CCCC(CC)OC=O
InChIInChI=1S/C10H18O2/c1-3-5-6-7-8-10(4-2)12-9-11/h3,5,9-10H,4,6-8H2,1-2H3/b5-3-
InChIKeyNIZPNORSTKCRSH-HYXAFXHYSA-N
MW170.25 g/mol
LogP2.68
Rot. Bonds7

About [(Z)-non-7-en-3-yl] formate

[(Z)-non-7-en-3-yl] formate (PubChem CID 87470057) has the molecular formula C10H18O2 and a molecular weight of 170.25 g/mol. Its IUPAC name is [(Z)-non-7-en-3-yl] formate.

Molecular Properties

Compound Name[(Z)-non-7-en-3-yl] formate
PubChem CID87470057
Molecular FormulaC10H18O2
Molecular Weight170.25 g/mol
Exact Mass170.13
IUPAC Name[(Z)-non-7-en-3-yl] formate
SMILESC/C=C\CCCC(CC)OC=O
InChIInChI=1S/C10H18O2/c1-3-5-6-7-8-10(4-2)12-9-11/h3,5,9-10H,4,6-8H2,1-2H3/b5-3-
InChIKeyNIZPNORSTKCRSH-HYXAFXHYSA-N
XLogP2.68
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.25
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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'}

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Related Compounds

7,8-dimethyldec-2-ene
CID 123474152
bis[[(Z)-undec-9-en-5-yl]oxy] carbonate
CID 87574859
5,7-diformyloxynonan-3-yl formate
CID 118296602
(E)-7,7-difluorohept-2-ene
CID 58814949
octadecan-8-yl formate
CID 171797323
hexatriacontan-18-yl formate
CID 144696165
acetaldehyde;hexane;bis((E)-hex-2-ene);pentane
CID 160632813
tetratriaconta-3,6,25,28-tetraen-16-yl formate
CID 91592372
hex-2-ene;3-methylpentane
CID 161117572
2-ethylhept-5-enal
CID 159875666
(Z)-hept-5-enal
CID 12625719
oct-1-en-4-yl formate
CID 87501677

Frequently Asked Questions

What is the IUPAC name of [(Z)-non-7-en-3-yl] formate?
The IUPAC name of [(Z)-non-7-en-3-yl] formate (CID 87470057) is [(Z)-non-7-en-3-yl] formate.
What is the SMILES notation for [(Z)-non-7-en-3-yl] formate?
The canonical SMILES for [(Z)-non-7-en-3-yl] formate is C/C=C\CCCC(CC)OC=O.
What is the InChIKey of [(Z)-non-7-en-3-yl] formate?
The InChIKey is NIZPNORSTKCRSH-HYXAFXHYSA-N. The full InChI is InChI=1S/C10H18O2/c1-3-5-6-7-8-10(4-2)12-9-11/h3,5,9-10H,4,6-8H2,1-2H3/b5-3-.
What are the key properties of [(Z)-non-7-en-3-yl] formate?
[(Z)-non-7-en-3-yl] formate has a molecular weight of 170.25 g/mol, XLogP of 2.68, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-non-7-en-3-yl] formate is sourced from PubChem (CID 87470057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).