(Z)-1-chlorodec-1-en-3-yne

C10H15Cl — CID 124646971

IUPAC(Z)-1-chlorodec-1-en-3-yne
SMILESCCCCCCC#C/C=C\Cl
InChIInChI=1S/C10H15Cl/c1-2-3-4-5-6-7-8-9-10-11/h9-10H,2-6H2,1H3/b10-9-
InChIKeyVCYBTQJFHZUNNG-KTKRTIGZSA-N
MW170.68 g/mol
LogP3.71
Rot. Bonds4

About (Z)-1-chlorodec-1-en-3-yne

(Z)-1-chlorodec-1-en-3-yne (PubChem CID 124646971) has the molecular formula C10H15Cl and a molecular weight of 170.68 g/mol. Its IUPAC name is (Z)-1-chlorodec-1-en-3-yne.

Molecular Properties

Compound Name(Z)-1-chlorodec-1-en-3-yne
PubChem CID124646971
Molecular FormulaC10H15Cl
Molecular Weight170.68 g/mol
Exact Mass170.09
IUPAC Name(Z)-1-chlorodec-1-en-3-yne
SMILESCCCCCCC#C/C=C\Cl
InChIInChI=1S/C10H15Cl/c1-2-3-4-5-6-7-8-9-10-11/h9-10H,2-6H2,1H3/b10-9-
InChIKeyVCYBTQJFHZUNNG-KTKRTIGZSA-N
XLogP3.71
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.68
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1-iodonon-1-en-3-yne
CID 71425479
(Z)-heptadec-3-en-5-yne
CID 5367448
(Z)-9-chloronon-8-en-6-yn-1-ol
CID 15169922
dec-2-en-4-yne
CID 54142868
(Z)-heptadec-8-en-6-yne
CID 101260338
(E)-undec-3-en-5-yne
CID 5367449
(Z)-tetradec-6-en-4,8-diyn-1-ol
CID 100971906
(Z)-1-butylsulfanyldec-1-en-3-yne
CID 102456339
henicos-8-yne
CID 22224321
(E)-tridec-4-en-6-yn-1-ol
CID 15420486
(3Z)-2-methylundeca-1,3-dien-5-yne
CID 102067427
(E)-non-2-en-4-yne
CID 5367387

Frequently Asked Questions

What is the IUPAC name of (Z)-1-chlorodec-1-en-3-yne?
The IUPAC name of (Z)-1-chlorodec-1-en-3-yne (CID 124646971) is (Z)-1-chlorodec-1-en-3-yne.
What is the SMILES notation for (Z)-1-chlorodec-1-en-3-yne?
The canonical SMILES for (Z)-1-chlorodec-1-en-3-yne is CCCCCCC#C/C=C\Cl.
What is the InChIKey of (Z)-1-chlorodec-1-en-3-yne?
The InChIKey is VCYBTQJFHZUNNG-KTKRTIGZSA-N. The full InChI is InChI=1S/C10H15Cl/c1-2-3-4-5-6-7-8-9-10-11/h9-10H,2-6H2,1H3/b10-9-.
What are the key properties of (Z)-1-chlorodec-1-en-3-yne?
(Z)-1-chlorodec-1-en-3-yne has a molecular weight of 170.68 g/mol, XLogP of 3.71, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-chlorodec-1-en-3-yne is sourced from PubChem (CID 124646971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).