acetylene;1-[(Z)-1,1-difluorobut-2-en-2-yl]-1-propan-2-ylhydrazine

C9H16F2N2 — CID 168933133

IUPACacetylene;1-[(Z)-1,1-difluorobut-2-en-2-yl]-1-propan-2-ylhydrazine
SMILESC#C.C/C=C(/C(F)F)N(N)C(C)C
InChIInChI=1S/C7H14F2N2.C2H2/c1-4-6(7(8)9)11(10)5(2)3;1-2/h4-5,7H,10H2,1-3H3;1-2H/b6-4-;
InChIKeyGSSFOVGNBSFVNF-YHSAGPEESA-N
MW190.24 g/mol
LogP1.99
Rot. Bonds3

About acetylene;1-[(Z)-1,1-difluorobut-2-en-2-yl]-1-propan-2-ylhydrazine

acetylene;1-[(Z)-1,1-difluorobut-2-en-2-yl]-1-propan-2-ylhydrazine (PubChem CID 168933133) has the molecular formula C9H16F2N2 and a molecular weight of 190.24 g/mol. Its IUPAC name is acetylene;1-[(Z)-1,1-difluorobut-2-en-2-yl]-1-propan-2-ylhydrazine.

Molecular Properties

Compound Nameacetylene;1-[(Z)-1,1-difluorobut-2-en-2-yl]-1-propan-2-ylhydrazine
PubChem CID168933133
Molecular FormulaC9H16F2N2
Molecular Weight190.24 g/mol
Exact Mass190.13
IUPAC Nameacetylene;1-[(Z)-1,1-difluorobut-2-en-2-yl]-1-propan-2-ylhydrazine
SMILESC#C.C/C=C(/C(F)F)N(N)C(C)C
InChIInChI=1S/C7H14F2N2.C2H2/c1-4-6(7(8)9)11(10)5(2)3;1-2/h4-5,7H,10H2,1-3H3;1-2H/b6-4-;
InChIKeyGSSFOVGNBSFVNF-YHSAGPEESA-N
XLogP1.99
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.24
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-[(Z)-1,1-difluorobut-2-en-2-yl]-1-propan-2-ylhydrazine
CID 168933134
1-[(Z)-but-2-en-2-yl]-1-(2-fluoroethyl)hydrazine;ethane
CID 143459174

Frequently Asked Questions

What is the IUPAC name of acetylene;1-[(Z)-1,1-difluorobut-2-en-2-yl]-1-propan-2-ylhydrazine?
The IUPAC name of acetylene;1-[(Z)-1,1-difluorobut-2-en-2-yl]-1-propan-2-ylhydrazine (CID 168933133) is acetylene;1-[(Z)-1,1-difluorobut-2-en-2-yl]-1-propan-2-ylhydrazine.
What is the SMILES notation for acetylene;1-[(Z)-1,1-difluorobut-2-en-2-yl]-1-propan-2-ylhydrazine?
The canonical SMILES for acetylene;1-[(Z)-1,1-difluorobut-2-en-2-yl]-1-propan-2-ylhydrazine is C#C.C/C=C(/C(F)F)N(N)C(C)C.
What is the InChIKey of acetylene;1-[(Z)-1,1-difluorobut-2-en-2-yl]-1-propan-2-ylhydrazine?
The InChIKey is GSSFOVGNBSFVNF-YHSAGPEESA-N. The full InChI is InChI=1S/C7H14F2N2.C2H2/c1-4-6(7(8)9)11(10)5(2)3;1-2/h4-5,7H,10H2,1-3H3;1-2H/b6-4-;.
What are the key properties of acetylene;1-[(Z)-1,1-difluorobut-2-en-2-yl]-1-propan-2-ylhydrazine?
acetylene;1-[(Z)-1,1-difluorobut-2-en-2-yl]-1-propan-2-ylhydrazine has a molecular weight of 190.24 g/mol, XLogP of 1.99, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for acetylene;1-[(Z)-1,1-difluorobut-2-en-2-yl]-1-propan-2-ylhydrazine is sourced from PubChem (CID 168933133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).