(Z)-6,9,9-trimethyl-7-propan-2-yldec-4-en-3-ol

C16H32O — CID 88580600

IUPAC(Z)-6,9,9-trimethyl-7-propan-2-yldec-4-en-3-ol
SMILESCCC(O)/C=C\C(C)C(CC(C)(C)C)C(C)C
InChIInChI=1S/C16H32O/c1-8-14(17)10-9-13(4)15(12(2)3)11-16(5,6)7/h9-10,12-15,17H,8,11H2,1-7H3/b10-9-
InChIKeyYHAYFGPEVOVOIL-KTKRTIGZSA-N
MW240.43 g/mol
LogP4.66
Rot. Bonds6

About (Z)-6,9,9-trimethyl-7-propan-2-yldec-4-en-3-ol

(Z)-6,9,9-trimethyl-7-propan-2-yldec-4-en-3-ol (PubChem CID 88580600) has the molecular formula C16H32O and a molecular weight of 240.43 g/mol. Its IUPAC name is (Z)-6,9,9-trimethyl-7-propan-2-yldec-4-en-3-ol.

Molecular Properties

Compound Name(Z)-6,9,9-trimethyl-7-propan-2-yldec-4-en-3-ol
PubChem CID88580600
Molecular FormulaC16H32O
Molecular Weight240.43 g/mol
Exact Mass240.25
IUPAC Name(Z)-6,9,9-trimethyl-7-propan-2-yldec-4-en-3-ol
SMILESCCC(O)/C=C\C(C)C(CC(C)(C)C)C(C)C
InChIInChI=1S/C16H32O/c1-8-14(17)10-9-13(4)15(12(2)3)11-16(5,6)7/h9-10,12-15,17H,8,11H2,1-7H3/b10-9-
InChIKeyYHAYFGPEVOVOIL-KTKRTIGZSA-N
XLogP4.66
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.43
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (Z)-6,9,9-trimethyl-7-propan-2-yldec-4-en-3-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,2,5,6-tetramethyl-4-propan-2-ylnonane
CID 123310465
(7S)-2,2,7-trimethylnonan-4-ol
CID 168764974
(E)-hex-4-en-3-ol
CID 5366234
(3R)-2,5,5-trimethylhexan-3-ol
CID 167343865
3,5,7,7-tetramethyloctan-4-ol
CID 156689232
(2R)-4,4-dimethylpentan-2-ol
CID 7014873
(E,3R)-hept-4-en-3-ol
CID 11007865
2,2-dimethylbutane;3,3-dimethylbutan-2-ol;2,2,3-trimethylbutane
CID 158901240
5-hydroxyhept-3-en-2-one
CID 74046190
5,5-dimethyl-3-propan-2-ylheptan-2-ol
CID 156689554
(Z,4R)-N,2,2,7,8-pentamethylnon-5-en-4-amine
CID 137429083
2,2,4,6-tetramethylnonan-5-ol
CID 156689294

Frequently Asked Questions

What is the IUPAC name of (Z)-6,9,9-trimethyl-7-propan-2-yldec-4-en-3-ol?
The IUPAC name of (Z)-6,9,9-trimethyl-7-propan-2-yldec-4-en-3-ol (CID 88580600) is (Z)-6,9,9-trimethyl-7-propan-2-yldec-4-en-3-ol.
What is the SMILES notation for (Z)-6,9,9-trimethyl-7-propan-2-yldec-4-en-3-ol?
The canonical SMILES for (Z)-6,9,9-trimethyl-7-propan-2-yldec-4-en-3-ol is CCC(O)/C=C\C(C)C(CC(C)(C)C)C(C)C.
What is the InChIKey of (Z)-6,9,9-trimethyl-7-propan-2-yldec-4-en-3-ol?
The InChIKey is YHAYFGPEVOVOIL-KTKRTIGZSA-N. The full InChI is InChI=1S/C16H32O/c1-8-14(17)10-9-13(4)15(12(2)3)11-16(5,6)7/h9-10,12-15,17H,8,11H2,1-7H3/b10-9-.
What are the key properties of (Z)-6,9,9-trimethyl-7-propan-2-yldec-4-en-3-ol?
(Z)-6,9,9-trimethyl-7-propan-2-yldec-4-en-3-ol has a molecular weight of 240.43 g/mol, XLogP of 4.66, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-6,9,9-trimethyl-7-propan-2-yldec-4-en-3-ol is sourced from PubChem (CID 88580600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).