(7,7,7-trifluoro-2-methoxy-2-methylheptan-3-yl)hydrazine

C9H19F3N2O — CID 105245336

IUPAC(7,7,7-trifluoro-2-methoxy-2-methylheptan-3-yl)hydrazine
SMILESCOC(C)(C)C(CCCC(F)(F)F)NN
InChIInChI=1S/C9H19F3N2O/c1-8(2,15-3)7(14-13)5-4-6-9(10,11)12/h7,14H,4-6,13H2,1-3H3
InChIKeyYUHQYPUIQVNIEJ-UHFFFAOYSA-N
MW228.26 g/mol
LogP1.98
Rot. Bonds6

About (7,7,7-trifluoro-2-methoxy-2-methylheptan-3-yl)hydrazine

(7,7,7-trifluoro-2-methoxy-2-methylheptan-3-yl)hydrazine (PubChem CID 105245336) has the molecular formula C9H19F3N2O and a molecular weight of 228.26 g/mol. Its IUPAC name is (7,7,7-trifluoro-2-methoxy-2-methylheptan-3-yl)hydrazine.

Molecular Properties

Compound Name(7,7,7-trifluoro-2-methoxy-2-methylheptan-3-yl)hydrazine
PubChem CID105245336
Molecular FormulaC9H19F3N2O
Molecular Weight228.26 g/mol
Exact Mass228.14
IUPAC Name(7,7,7-trifluoro-2-methoxy-2-methylheptan-3-yl)hydrazine
SMILESCOC(C)(C)C(CCCC(F)(F)F)NN
InChIInChI=1S/C9H19F3N2O/c1-8(2,15-3)7(14-13)5-4-6-9(10,11)12/h7,14H,4-6,13H2,1-3H3
InChIKeyYUHQYPUIQVNIEJ-UHFFFAOYSA-N
XLogP1.98
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.26
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(1,1,1-Trifluoro-6-methoxy-6-methylheptan-4-yl)hydrazine
CID 103025356
(8,8,8-Trifluoro-2-methoxy-2-methyloctan-4-yl)hydrazine
CID 103025443
(1,1,1-Trifluoro-7-methoxy-7-methyloctan-4-yl)hydrazine
CID 103026297
(1,1,1-Trifluoro-6-methoxy-6-methylheptan-3-yl)hydrazine
CID 103026460
(1,1,1-Trifluoro-5-methoxy-5-methylhexan-2-yl)hydrazine
CID 103026599
(1,1-Difluoro-5-methoxy-5-methylhexan-2-yl)hydrazine
CID 103027034
[6-Methoxy-6-methyl-1-(2,2,2-trifluoroethoxy)heptan-3-yl]hydrazine
CID 103151680
[1-(2,2-Difluoroethoxy)-6-methoxy-6-methylheptan-3-yl]hydrazine
CID 103152015
[4-Ethyl-1-(2,2,2-trifluoroethoxy)octan-2-yl]hydrazine
CID 103217300
[5-Methyl-1-(2,2,2-trifluoroethoxy)hexan-2-yl]hydrazine
CID 103217357
[4-Methyl-1-(2,2,2-trifluoroethoxy)heptan-2-yl]hydrazine
CID 103217396
[4-Methyl-1-(2,2,2-trifluoroethoxy)hexan-2-yl]hydrazine
CID 103217399

Frequently Asked Questions

What is the IUPAC name of (7,7,7-trifluoro-2-methoxy-2-methylheptan-3-yl)hydrazine?
The IUPAC name of (7,7,7-trifluoro-2-methoxy-2-methylheptan-3-yl)hydrazine (CID 105245336) is (7,7,7-trifluoro-2-methoxy-2-methylheptan-3-yl)hydrazine.
What is the SMILES notation for (7,7,7-trifluoro-2-methoxy-2-methylheptan-3-yl)hydrazine?
The canonical SMILES for (7,7,7-trifluoro-2-methoxy-2-methylheptan-3-yl)hydrazine is COC(C)(C)C(CCCC(F)(F)F)NN.
What is the InChIKey of (7,7,7-trifluoro-2-methoxy-2-methylheptan-3-yl)hydrazine?
The InChIKey is YUHQYPUIQVNIEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19F3N2O/c1-8(2,15-3)7(14-13)5-4-6-9(10,11)12/h7,14H,4-6,13H2,1-3H3.
What are the key properties of (7,7,7-trifluoro-2-methoxy-2-methylheptan-3-yl)hydrazine?
(7,7,7-trifluoro-2-methoxy-2-methylheptan-3-yl)hydrazine has a molecular weight of 228.26 g/mol, XLogP of 1.98, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (7,7,7-trifluoro-2-methoxy-2-methylheptan-3-yl)hydrazine is sourced from PubChem (CID 105245336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).