7-hydroxyimino-5,8-dimethyldodecan-6-ol

C14H29NO2 — CID 150209284

IUPAC7-hydroxyimino-5,8-dimethyldodecan-6-ol
SMILESCCCCC(C)C(=NO)C(O)C(C)CCCC
InChIInChI=1S/C14H29NO2/c1-5-7-9-11(3)13(15-17)14(16)12(4)10-8-6-2/h11-12,14,16-17H,5-10H2,1-4H3
InChIKeyFRDGZZVTGWFXIL-UHFFFAOYSA-N
MW243.39 g/mol
LogP3.83
Rot. Bonds9

About 7-hydroxyimino-5,8-dimethyldodecan-6-ol

7-hydroxyimino-5,8-dimethyldodecan-6-ol (PubChem CID 150209284) has the molecular formula C14H29NO2 and a molecular weight of 243.39 g/mol. Its IUPAC name is 7-hydroxyimino-5,8-dimethyldodecan-6-ol.

Molecular Properties

Compound Name7-hydroxyimino-5,8-dimethyldodecan-6-ol
PubChem CID150209284
Molecular FormulaC14H29NO2
Molecular Weight243.39 g/mol
Exact Mass243.22
IUPAC Name7-hydroxyimino-5,8-dimethyldodecan-6-ol
SMILESCCCCC(C)C(=NO)C(O)C(C)CCCC
InChIInChI=1S/C14H29NO2/c1-5-7-9-11(3)13(15-17)14(16)12(4)10-8-6-2/h11-12,14,16-17H,5-10H2,1-4H3
InChIKeyFRDGZZVTGWFXIL-UHFFFAOYSA-N
XLogP3.83
TPSA52.82 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.39
LogP ≤ 53.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

6-Dodecanone, 5,8-diethyl-7-hydroxy-, oxime
CID 5361049
5,8-Diethyl-7-hydroxydodecan-6-one oxime
CID 38274
8-Diethyl-7-hydroxy-6-dodecanone oxime
CID 88690740
5,8-Diethyl-7-hydroxy-6-dodecanonoxime; 5,8-Diethyl-7-hydroxydodecan-6-oxime; 5,8-Diethyl-7-hydroxydodecane-6-oxime; LIX 63
CID 5371503
1-(4,5,6,6-Tetramethyl-4,5-dihydrooxazin-3-yl)ethanol
CID 134856743
(3Z)-2-butyl-3-hydroxyiminocyclohexan-1-ol
CID 134992670
(4R,5S)-5-butyl-3-tert-butyl-4,5-dihydro-1,2-oxazol-4-ol
CID 146018742
(3-Nonyl-4,5-dihydro-1,2-oxazol-4-yl)methanol
CID 11053382
1-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]cyclohexyl]ethanol
CID 133615818
(6E)-6-hydroxyiminodecan-5-ol
CID 22415947
(7E)-7-hydroxyiminododecan-6-ol
CID 22755115
(6E)-6-hydroxyimino-2,9-dimethyldecan-5-ol
CID 22755117

Frequently Asked Questions

What is the IUPAC name of 7-hydroxyimino-5,8-dimethyldodecan-6-ol?
The IUPAC name of 7-hydroxyimino-5,8-dimethyldodecan-6-ol (CID 150209284) is 7-hydroxyimino-5,8-dimethyldodecan-6-ol.
What is the SMILES notation for 7-hydroxyimino-5,8-dimethyldodecan-6-ol?
The canonical SMILES for 7-hydroxyimino-5,8-dimethyldodecan-6-ol is CCCCC(C)C(=NO)C(O)C(C)CCCC.
What is the InChIKey of 7-hydroxyimino-5,8-dimethyldodecan-6-ol?
The InChIKey is FRDGZZVTGWFXIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO2/c1-5-7-9-11(3)13(15-17)14(16)12(4)10-8-6-2/h11-12,14,16-17H,5-10H2,1-4H3.
What are the key properties of 7-hydroxyimino-5,8-dimethyldodecan-6-ol?
7-hydroxyimino-5,8-dimethyldodecan-6-ol has a molecular weight of 243.39 g/mol, XLogP of 3.83, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-hydroxyimino-5,8-dimethyldodecan-6-ol is sourced from PubChem (CID 150209284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).