difluoromethane;1,1,1,3-tetrafluoropropane

C4H6F6 — CID 91452847

IUPACdifluoromethane;1,1,1,3-tetrafluoropropane
SMILESFCCC(F)(F)F.FCF
InChIInChI=1S/C3H4F4.CH2F2/c4-2-1-3(5,6)7;2-1-3/h1-2H2;1H2
InChIKeyZTJKEBLRLQOHKA-UHFFFAOYSA-N
MW168.08 g/mol
LogP2.79
Rot. Bonds1

About difluoromethane;1,1,1,3-tetrafluoropropane

difluoromethane;1,1,1,3-tetrafluoropropane (PubChem CID 91452847) has the molecular formula C4H6F6 and a molecular weight of 168.08 g/mol. Its IUPAC name is difluoromethane;1,1,1,3-tetrafluoropropane.

Molecular Properties

Compound Namedifluoromethane;1,1,1,3-tetrafluoropropane
PubChem CID91452847
Molecular FormulaC4H6F6
Molecular Weight168.08 g/mol
Exact Mass168.04
IUPAC Namedifluoromethane;1,1,1,3-tetrafluoropropane
SMILESFCCC(F)(F)F.FCF
InChIInChI=1S/C3H4F4.CH2F2/c4-2-1-3(5,6)7;2-1-3/h1-2H2;1H2
InChIKeyZTJKEBLRLQOHKA-UHFFFAOYSA-N
XLogP2.79
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.08
LogP ≤ 52.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

disilyl(3,3,3-trifluoropropyl)silane
CID 123648893
1,1,1,10-tetrafluorodecane
CID 150433562
3,3,3-tri(18F)fluoropropan-1-amine
CID 10154023
2-(2-fluoroethyl)-2-(3,3,3-trifluoropropyl)propanedinitrile
CID 87395428
1,1-dichloro-1,3-difluoropropane
CID 14226151
1,1,1,4-tetrafluoro-2,2-bis(trifluoromethyl)butane
CID 177246313
1,1,3-trifluoropropan-1-ol
CID 18319092
1,1-dibromo-1,3-difluoropropane
CID 165362218
chloromethyl-bis(3,3,3-trifluoropropyl)silane
CID 123967861
2-fluoroethyl hypofluorite;methyl hypofluorite;1,1,1-trifluorobutane
CID 91023301
2,2-bis(3,3,3-trifluoropropyl)propane-1,3-diamine
CID 59339468
1,1,1-trifluoro-4-(4,4,4-trifluorobutoxy)butane
CID 22483429

Frequently Asked Questions

What is the IUPAC name of difluoromethane;1,1,1,3-tetrafluoropropane?
The IUPAC name of difluoromethane;1,1,1,3-tetrafluoropropane (CID 91452847) is difluoromethane;1,1,1,3-tetrafluoropropane.
What is the SMILES notation for difluoromethane;1,1,1,3-tetrafluoropropane?
The canonical SMILES for difluoromethane;1,1,1,3-tetrafluoropropane is FCCC(F)(F)F.FCF.
What is the InChIKey of difluoromethane;1,1,1,3-tetrafluoropropane?
The InChIKey is ZTJKEBLRLQOHKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H4F4.CH2F2/c4-2-1-3(5,6)7;2-1-3/h1-2H2;1H2.
What are the key properties of difluoromethane;1,1,1,3-tetrafluoropropane?
difluoromethane;1,1,1,3-tetrafluoropropane has a molecular weight of 168.08 g/mol, XLogP of 2.79, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for difluoromethane;1,1,1,3-tetrafluoropropane is sourced from PubChem (CID 91452847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).