(Z)-4,4,4-trifluorobut-1-en-1-amine

C4H6F3N — CID 142852189

IUPAC(Z)-4,4,4-trifluorobut-1-en-1-amine
SMILESN/C=C\CC(F)(F)F
InChIInChI=1S/C4H6F3N/c5-4(6,7)2-1-3-8/h1,3H,2,8H2/b3-1-
InChIKeyXNABQFWCCNPHEI-IWQZZHSRSA-N
MW125.09 g/mol
LogP1.41
Rot. Bonds1

About (Z)-4,4,4-trifluorobut-1-en-1-amine

(Z)-4,4,4-trifluorobut-1-en-1-amine (PubChem CID 142852189) has the molecular formula C4H6F3N and a molecular weight of 125.09 g/mol. Its IUPAC name is (Z)-4,4,4-trifluorobut-1-en-1-amine.

Molecular Properties

Compound Name(Z)-4,4,4-trifluorobut-1-en-1-amine
PubChem CID142852189
Molecular FormulaC4H6F3N
Molecular Weight125.09 g/mol
Exact Mass125.05
IUPAC Name(Z)-4,4,4-trifluorobut-1-en-1-amine
SMILESN/C=C\CC(F)(F)F
InChIInChI=1S/C4H6F3N/c5-4(6,7)2-1-3-8/h1,3H,2,8H2/b3-1-
InChIKeyXNABQFWCCNPHEI-IWQZZHSRSA-N
XLogP1.41
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.09
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 55296417
bis[(E)-6,6,6-trifluorohex-3-enyl] oxalate
CID 162617388
ethyl(4,4,4-trifluorobut-1-enyl)phosphinic acid
CID 154509979
7,7,7-trifluoro-3-methylhepta-2,4-diene
CID 123499921
(E)-1,1,1,7,7,8,8,8-octafluorooct-3-ene
CID 90213776
ethyl (E)-5,5,5-trifluoropent-2-enoate
CID 15104041
(Z)-1,1,1-trifluoro-5-methylhept-3-ene
CID 154518878
methane;4,4,4-trifluorobut-1-ene
CID 157244358
azane;4,4,4-trifluorobut-1-ene
CID 166791740
methyl(4,4,4-trifluorobut-1-enyl)phosphinic acid
CID 154509976

Frequently Asked Questions

What is the IUPAC name of (Z)-4,4,4-trifluorobut-1-en-1-amine?
The IUPAC name of (Z)-4,4,4-trifluorobut-1-en-1-amine (CID 142852189) is (Z)-4,4,4-trifluorobut-1-en-1-amine.
What is the SMILES notation for (Z)-4,4,4-trifluorobut-1-en-1-amine?
The canonical SMILES for (Z)-4,4,4-trifluorobut-1-en-1-amine is N/C=C\CC(F)(F)F.
What is the InChIKey of (Z)-4,4,4-trifluorobut-1-en-1-amine?
The InChIKey is XNABQFWCCNPHEI-IWQZZHSRSA-N. The full InChI is InChI=1S/C4H6F3N/c5-4(6,7)2-1-3-8/h1,3H,2,8H2/b3-1-.
What are the key properties of (Z)-4,4,4-trifluorobut-1-en-1-amine?
(Z)-4,4,4-trifluorobut-1-en-1-amine has a molecular weight of 125.09 g/mol, XLogP of 1.41, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4,4,4-trifluorobut-1-en-1-amine is sourced from PubChem (CID 142852189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).