(3Z,5Z)-3-ethyl-5-methylhepta-1,3,5-trien-2-ol

C10H16O — CID 142260565

IUPAC(3Z,5Z)-3-ethyl-5-methylhepta-1,3,5-trien-2-ol
SMILESC=C(O)/C(=C\C(C)=C/C)CC
InChIInChI=1S/C10H16O/c1-5-8(3)7-10(6-2)9(4)11/h5,7,11H,4,6H2,1-3H3/b8-5-,10-7-
InChIKeyGGBLMPDNOMTFRN-OUOSTHCTSA-N
MW152.24 g/mol
LogP3.36
Rot. Bonds3

About (3Z,5Z)-3-ethyl-5-methylhepta-1,3,5-trien-2-ol

(3Z,5Z)-3-ethyl-5-methylhepta-1,3,5-trien-2-ol (PubChem CID 142260565) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is (3Z,5Z)-3-ethyl-5-methylhepta-1,3,5-trien-2-ol.

Molecular Properties

Compound Name(3Z,5Z)-3-ethyl-5-methylhepta-1,3,5-trien-2-ol
PubChem CID142260565
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Name(3Z,5Z)-3-ethyl-5-methylhepta-1,3,5-trien-2-ol
SMILESC=C(O)/C(=C\C(C)=C/C)CC
InChIInChI=1S/C10H16O/c1-5-8(3)7-10(6-2)9(4)11/h5,7,11H,4,6H2,1-3H3/b8-5-,10-7-
InChIKeyGGBLMPDNOMTFRN-OUOSTHCTSA-N
XLogP3.36
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 ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

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2,5-dimethyl-3-prop-1-en-2-ylhepta-1,3,5-triene
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(2Z,4Z)-3-ethyl-4-methyl-6-methylidenenona-2,4-diene
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(2E,4E,6E)-5-ethyl-3,7-dimethylnona-2,4,6-triene
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(E)-but-2-ene;2-methylbut-1-ene
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but-2-ene;2-methylbut-1-ene
CID 160732246
4-methylhexa-2,4-diene-1,2-diol
CID 174371366
5-methylhepta-3,5-dien-3-ylbenzene
CID 123274191
3-ethyl-5-methylhepta-3,5-diene-2,2-diol
CID 123669742
(3E,4Z)-3-ethylidene-4,5-dimethylhepta-1,4-dien-2-ol
CID 126639403
(3E,5Z)-2,5-dimethylhepta-1,3,5-trien-3-amine
CID 142809579
(1Z)-2-ethyl-3-methylbuta-1,3-dien-1-amine
CID 143331601

Frequently Asked Questions

What is the IUPAC name of (3Z,5Z)-3-ethyl-5-methylhepta-1,3,5-trien-2-ol?
The IUPAC name of (3Z,5Z)-3-ethyl-5-methylhepta-1,3,5-trien-2-ol (CID 142260565) is (3Z,5Z)-3-ethyl-5-methylhepta-1,3,5-trien-2-ol.
What is the SMILES notation for (3Z,5Z)-3-ethyl-5-methylhepta-1,3,5-trien-2-ol?
The canonical SMILES for (3Z,5Z)-3-ethyl-5-methylhepta-1,3,5-trien-2-ol is C=C(O)/C(=C\C(C)=C/C)CC.
What is the InChIKey of (3Z,5Z)-3-ethyl-5-methylhepta-1,3,5-trien-2-ol?
The InChIKey is GGBLMPDNOMTFRN-OUOSTHCTSA-N. The full InChI is InChI=1S/C10H16O/c1-5-8(3)7-10(6-2)9(4)11/h5,7,11H,4,6H2,1-3H3/b8-5-,10-7-.
What are the key properties of (3Z,5Z)-3-ethyl-5-methylhepta-1,3,5-trien-2-ol?
(3Z,5Z)-3-ethyl-5-methylhepta-1,3,5-trien-2-ol has a molecular weight of 152.24 g/mol, XLogP of 3.36, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z,5Z)-3-ethyl-5-methylhepta-1,3,5-trien-2-ol is sourced from PubChem (CID 142260565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).