(Z)-1-methoxy-3,3-dimethylnon-1-ene

C12H24O — CID 87440887

IUPAC(Z)-1-methoxy-3,3-dimethylnon-1-ene
SMILESCCCCCCC(C)(C)/C=C\OC
InChIInChI=1S/C12H24O/c1-5-6-7-8-9-12(2,3)10-11-13-4/h10-11H,5-9H2,1-4H3/b11-10-
InChIKeyNTRRELLNFDBHSY-KHPPLWFESA-N
MW184.32 g/mol
LogP4.14
Rot. Bonds7

About (Z)-1-methoxy-3,3-dimethylnon-1-ene

(Z)-1-methoxy-3,3-dimethylnon-1-ene (PubChem CID 87440887) has the molecular formula C12H24O and a molecular weight of 184.32 g/mol. Its IUPAC name is (Z)-1-methoxy-3,3-dimethylnon-1-ene.

Molecular Properties

Compound Name(Z)-1-methoxy-3,3-dimethylnon-1-ene
PubChem CID87440887
Molecular FormulaC12H24O
Molecular Weight184.32 g/mol
Exact Mass184.18
IUPAC Name(Z)-1-methoxy-3,3-dimethylnon-1-ene
SMILESCCCCCCC(C)(C)/C=C\OC
InChIInChI=1S/C12H24O/c1-5-6-7-8-9-12(2,3)10-11-13-4/h10-11H,5-9H2,1-4H3/b11-10-
InChIKeyNTRRELLNFDBHSY-KHPPLWFESA-N
XLogP4.14
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.32
LogP ≤ 54.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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CID 54495291
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CID 134907473
3,3-dimethylnon-1-enylbenzene
CID 173227599
(Z)-1-methoxydec-1-ene
CID 10888349
2,2-diethoxynonane
CID 89439020
(E)-1-methoxytridec-1-ene
CID 87204968
(E)-4-ethyl-4-methyldec-2-ene
CID 134979777
1-diazo-2,2-dimethylundecane
CID 151446398
11-methyl-11-nonylhenicosane
CID 19690388
13-methyl-13-octylhentriacontane
CID 173152457
16,16,21,21-tetramethylhexatriacontane
CID 174880889

Frequently Asked Questions

What is the IUPAC name of (Z)-1-methoxy-3,3-dimethylnon-1-ene?
The IUPAC name of (Z)-1-methoxy-3,3-dimethylnon-1-ene (CID 87440887) is (Z)-1-methoxy-3,3-dimethylnon-1-ene.
What is the SMILES notation for (Z)-1-methoxy-3,3-dimethylnon-1-ene?
The canonical SMILES for (Z)-1-methoxy-3,3-dimethylnon-1-ene is CCCCCCC(C)(C)/C=C\OC.
What is the InChIKey of (Z)-1-methoxy-3,3-dimethylnon-1-ene?
The InChIKey is NTRRELLNFDBHSY-KHPPLWFESA-N. The full InChI is InChI=1S/C12H24O/c1-5-6-7-8-9-12(2,3)10-11-13-4/h10-11H,5-9H2,1-4H3/b11-10-.
What are the key properties of (Z)-1-methoxy-3,3-dimethylnon-1-ene?
(Z)-1-methoxy-3,3-dimethylnon-1-ene has a molecular weight of 184.32 g/mol, XLogP of 4.14, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-methoxy-3,3-dimethylnon-1-ene is sourced from PubChem (CID 87440887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).