(Z)-1-chloro-8-ethyltetradec-7-ene

C16H31Cl — CID 56601212

IUPAC(Z)-1-chloro-8-ethyltetradec-7-ene
SMILESCCCCCC/C(=C\CCCCCCCl)CC
InChIInChI=1S/C16H31Cl/c1-3-5-6-10-13-16(4-2)14-11-8-7-9-12-15-17/h14H,3-13,15H2,1-2H3/b16-14-
InChIKeyJNCOVAGHRCUHOR-PEZBUJJGSA-N
MW258.88 g/mol
LogP6.48
Rot. Bonds12

About (Z)-1-chloro-8-ethyltetradec-7-ene

(Z)-1-chloro-8-ethyltetradec-7-ene (PubChem CID 56601212) has the molecular formula C16H31Cl and a molecular weight of 258.88 g/mol. Its IUPAC name is (Z)-1-chloro-8-ethyltetradec-7-ene.

Molecular Properties

Compound Name(Z)-1-chloro-8-ethyltetradec-7-ene
PubChem CID56601212
Molecular FormulaC16H31Cl
Molecular Weight258.88 g/mol
Exact Mass258.21
IUPAC Name(Z)-1-chloro-8-ethyltetradec-7-ene
SMILESCCCCCC/C(=C\CCCCCCCl)CC
InChIInChI=1S/C16H31Cl/c1-3-5-6-10-13-16(4-2)14-11-8-7-9-12-15-17/h14H,3-13,15H2,1-2H3/b16-14-
InChIKeyJNCOVAGHRCUHOR-PEZBUJJGSA-N
XLogP6.48
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds12
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500258.88
LogP ≤ 56.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-1-chloro-8-ethyltetradec-7-ene?
The IUPAC name of (Z)-1-chloro-8-ethyltetradec-7-ene (CID 56601212) is (Z)-1-chloro-8-ethyltetradec-7-ene.
What is the SMILES notation for (Z)-1-chloro-8-ethyltetradec-7-ene?
The canonical SMILES for (Z)-1-chloro-8-ethyltetradec-7-ene is CCCCCC/C(=C\CCCCCCCl)CC.
What is the InChIKey of (Z)-1-chloro-8-ethyltetradec-7-ene?
The InChIKey is JNCOVAGHRCUHOR-PEZBUJJGSA-N. The full InChI is InChI=1S/C16H31Cl/c1-3-5-6-10-13-16(4-2)14-11-8-7-9-12-15-17/h14H,3-13,15H2,1-2H3/b16-14-.
What are the key properties of (Z)-1-chloro-8-ethyltetradec-7-ene?
(Z)-1-chloro-8-ethyltetradec-7-ene has a molecular weight of 258.88 g/mol, XLogP of 6.48, 12 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-chloro-8-ethyltetradec-7-ene is sourced from PubChem (CID 56601212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).