(5R)-3-methylidenedecan-5-ol

C11H22O — CID 118281319

IUPAC(5R)-3-methylidenedecan-5-ol
SMILESC=C(CC)C[C@H](O)CCCCC
InChIInChI=1S/C11H22O/c1-4-6-7-8-11(12)9-10(3)5-2/h11-12H,3-9H2,1-2H3/t11-/m1/s1
InChIKeyUPAIMJKCQPHNSM-LLVKDONJSA-N
MW170.30 g/mol
LogP3.28
Rot. Bonds7

About (5R)-3-methylidenedecan-5-ol

(5R)-3-methylidenedecan-5-ol (PubChem CID 118281319) has the molecular formula C11H22O and a molecular weight of 170.30 g/mol. Its IUPAC name is (5R)-3-methylidenedecan-5-ol.

Molecular Properties

Compound Name(5R)-3-methylidenedecan-5-ol
PubChem CID118281319
Molecular FormulaC11H22O
Molecular Weight170.30 g/mol
Exact Mass170.17
IUPAC Name(5R)-3-methylidenedecan-5-ol
SMILESC=C(CC)C[C@H](O)CCCCC
InChIInChI=1S/C11H22O/c1-4-6-7-8-11(12)9-10(3)5-2/h11-12H,3-9H2,1-2H3/t11-/m1/s1
InChIKeyUPAIMJKCQPHNSM-LLVKDONJSA-N
XLogP3.28
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 53.28
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'}

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Related Compounds

3-methylidenetetradecan-5-ol
CID 115817490
2-chlorodec-1-en-4-ol
CID 11030613
(5S)-5-hydroxydecan-3-one
CID 102362310
nonacosane-7,20-diol
CID 174949468
(7R)-hexatriacontan-7-ol
CID 88529159
icosan-9-ol
CID 11983377
tetracosan-6-ol
CID 154265400
tetratetracontan-22-ol
CID 91434437
icosan-6-ol
CID 19931277
hexatriacontan-17-ol
CID 3020851
octacosan-10-ol
CID 22568705
3-hydroxyoctanoic acid
CID 159718411

Frequently Asked Questions

What is the IUPAC name of (5R)-3-methylidenedecan-5-ol?
The IUPAC name of (5R)-3-methylidenedecan-5-ol (CID 118281319) is (5R)-3-methylidenedecan-5-ol.
What is the SMILES notation for (5R)-3-methylidenedecan-5-ol?
The canonical SMILES for (5R)-3-methylidenedecan-5-ol is C=C(CC)C[C@H](O)CCCCC.
What is the InChIKey of (5R)-3-methylidenedecan-5-ol?
The InChIKey is UPAIMJKCQPHNSM-LLVKDONJSA-N. The full InChI is InChI=1S/C11H22O/c1-4-6-7-8-11(12)9-10(3)5-2/h11-12H,3-9H2,1-2H3/t11-/m1/s1.
What are the key properties of (5R)-3-methylidenedecan-5-ol?
(5R)-3-methylidenedecan-5-ol has a molecular weight of 170.30 g/mol, XLogP of 3.28, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-3-methylidenedecan-5-ol is sourced from PubChem (CID 118281319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).