(Z)-9-chloronon-8-en-6-yn-1-ol

C9H13ClO — CID 15169922

IUPAC(Z)-9-chloronon-8-en-6-yn-1-ol
SMILESOCCCCCC#C/C=C\Cl
InChIInChI=1S/C9H13ClO/c10-8-6-4-2-1-3-5-7-9-11/h6,8,11H,1,3,5,7,9H2/b8-6-
InChIKeyMKQICFBWKVDLDT-VURMDHGXSA-N
MW172.66 g/mol
LogP2.30
Rot. Bonds4

About (Z)-9-chloronon-8-en-6-yn-1-ol

(Z)-9-chloronon-8-en-6-yn-1-ol (PubChem CID 15169922) has the molecular formula C9H13ClO and a molecular weight of 172.66 g/mol. Its IUPAC name is (Z)-9-chloronon-8-en-6-yn-1-ol.

Molecular Properties

Compound Name(Z)-9-chloronon-8-en-6-yn-1-ol
PubChem CID15169922
Molecular FormulaC9H13ClO
Molecular Weight172.66 g/mol
Exact Mass172.07
IUPAC Name(Z)-9-chloronon-8-en-6-yn-1-ol
SMILESOCCCCCC#C/C=C\Cl
InChIInChI=1S/C9H13ClO/c10-8-6-4-2-1-3-5-7-9-11/h6,8,11H,1,3,5,7,9H2/b8-6-
InChIKeyMKQICFBWKVDLDT-VURMDHGXSA-N
XLogP2.30
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.66
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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

(Z)-1-chlorodec-1-en-3-yne
CID 124646971
(Z)-tetradec-6-en-4,8-diyn-1-ol
CID 100971906
(E)-oct-2-en-4-yne-1,8-diol
CID 130123258
(E)-10-phosphanyloxyundec-8-en-6-yn-1-ol
CID 20579701
(E)-tridec-4-en-6-yn-1-ol
CID 15420486
non-2-yne-1,9-diol
CID 10997284
nonadeca-6,9,12-triyne-1,19-diol
CID 171715193
tert-butyl-[(Z)-10-chlorodec-9-en-7-ynoxy]-dimethylsilane
CID 87614824
undec-7-yn-1-ol
CID 10909966
non-6-yn-1-ol
CID 3017913
heptadec-8-yn-1-ol
CID 10491053
tetradec-5-yn-1-ol
CID 15730841

Frequently Asked Questions

What is the IUPAC name of (Z)-9-chloronon-8-en-6-yn-1-ol?
The IUPAC name of (Z)-9-chloronon-8-en-6-yn-1-ol (CID 15169922) is (Z)-9-chloronon-8-en-6-yn-1-ol.
What is the SMILES notation for (Z)-9-chloronon-8-en-6-yn-1-ol?
The canonical SMILES for (Z)-9-chloronon-8-en-6-yn-1-ol is OCCCCCC#C/C=C\Cl.
What is the InChIKey of (Z)-9-chloronon-8-en-6-yn-1-ol?
The InChIKey is MKQICFBWKVDLDT-VURMDHGXSA-N. The full InChI is InChI=1S/C9H13ClO/c10-8-6-4-2-1-3-5-7-9-11/h6,8,11H,1,3,5,7,9H2/b8-6-.
What are the key properties of (Z)-9-chloronon-8-en-6-yn-1-ol?
(Z)-9-chloronon-8-en-6-yn-1-ol has a molecular weight of 172.66 g/mol, XLogP of 2.30, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-9-chloronon-8-en-6-yn-1-ol is sourced from PubChem (CID 15169922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).