8-methylnon-7-en-2-yn-1-ol

C10H16O — CID 130127240

IUPAC8-methylnon-7-en-2-yn-1-ol
SMILESCC(C)=CCCCC#CCO
InChIInChI=1S/C10H16O/c1-10(2)8-6-4-3-5-7-9-11/h8,11H,3-4,6,9H2,1-2H3
InChIKeyMSAKWKBAXCJEFC-UHFFFAOYSA-N
MW152.24 g/mol
LogP2.12
Rot. Bonds3

About 8-methylnon-7-en-2-yn-1-ol

8-methylnon-7-en-2-yn-1-ol (PubChem CID 130127240) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is 8-methylnon-7-en-2-yn-1-ol.

Molecular Properties

Compound Name8-methylnon-7-en-2-yn-1-ol
PubChem CID130127240
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Name8-methylnon-7-en-2-yn-1-ol
SMILESCC(C)=CCCCC#CCO
InChIInChI=1S/C10H16O/c1-10(2)8-6-4-3-5-7-9-11/h8,11H,3-4,6,9H2,1-2H3
InChIKeyMSAKWKBAXCJEFC-UHFFFAOYSA-N
XLogP2.12
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(6E)-7,11-dimethyldodeca-6,10-dien-2-yn-1-ol
CID 11830599
8-bromo-2-methyloct-2-en-6-yne
CID 11745679
2-methyl-8-(3-methylbut-2-enoxy)oct-2-en-6-yne
CID 102356227
7-methyloct-6-en-3-yn-1-ol
CID 130128735
hexadec-2-yn-1-ol
CID 11010038
6-methoxy-2-methylhex-2-ene
CID 59087760
octadec-2-yn-1-ol
CID 2825194
non-2-yne-1,9-diol
CID 10997284
5-methylhex-4-ene-1-thiol
CID 123779789
dodec-2-yn-1-ol;undec-1-yne
CID 159187023
2-hydroxy-7-methyloct-6-enoic acid
CID 141345333
10-hydroxydeca-2,8-diynal
CID 11435128

Frequently Asked Questions

What is the IUPAC name of 8-methylnon-7-en-2-yn-1-ol?
The IUPAC name of 8-methylnon-7-en-2-yn-1-ol (CID 130127240) is 8-methylnon-7-en-2-yn-1-ol.
What is the SMILES notation for 8-methylnon-7-en-2-yn-1-ol?
The canonical SMILES for 8-methylnon-7-en-2-yn-1-ol is CC(C)=CCCCC#CCO.
What is the InChIKey of 8-methylnon-7-en-2-yn-1-ol?
The InChIKey is MSAKWKBAXCJEFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O/c1-10(2)8-6-4-3-5-7-9-11/h8,11H,3-4,6,9H2,1-2H3.
What are the key properties of 8-methylnon-7-en-2-yn-1-ol?
8-methylnon-7-en-2-yn-1-ol has a molecular weight of 152.24 g/mol, XLogP of 2.12, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methylnon-7-en-2-yn-1-ol is sourced from PubChem (CID 130127240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).