chloro(difluoro)methane

CHClF2 — CID 102425690

IUPACchloro(difluoro)methane
SMILESFC(F)[35Cl]
InChIInChI=1S/CHClF2/c2-1(3)4/h1H/i2+0
InChIKeyVOPWNXZWBYDODV-ULIRUUBJSA-N
MW85.98 g/mol
LogP1.45
Rot. Bonds

About chloro(difluoro)methane

chloro(difluoro)methane (PubChem CID 102425690) has the molecular formula CHClF2 and a molecular weight of 85.98 g/mol. Its IUPAC name is chloro(difluoro)methane.

Molecular Properties

Compound Namechloro(difluoro)methane
PubChem CID102425690
Molecular FormulaCHClF2
Molecular Weight85.98 g/mol
Exact Mass85.97
IUPAC Namechloro(difluoro)methane
SMILESFC(F)[35Cl]
InChIInChI=1S/CHClF2/c2-1(3)4/h1H/i2+0
InChIKeyVOPWNXZWBYDODV-ULIRUUBJSA-N
XLogP1.45
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50085.98
LogP ≤ 51.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

carbon dioxide;chloro(difluoro)methane
CID 161091167
chloro(difluoro)methane;dichloro(difluoro)methane;trichloro(fluoro)methane
CID 19892956
chloro(difluoro)methane;1,1,1-trichloro-2,2,2-trifluoroethane
CID 88770689
1-chloro-1,1-difluoroethane;chloro(difluoro)methane;dichloro(difluoro)methane
CID 157380637
(1R,2R)-1-bromo-1,2-dichloro-2-fluoroethane
CID 12714090
chloro(difluoro)methane;1-chloro-1,1,2,2,3,3-hexafluoropropane
CID 160658903
2-bromo-1-chloro-1-fluoroethane
CID 13299939
1-chloro-1-fluoro-2-iodoethane
CID 23262231
trichloro(113C)methane
CID 10176135
1,2-dichloro-1,1,2-trifluoroethane chloride
CID 158973247
1-chloro-1-fluoropropane;hydrofluoride
CID 174905950
dichloromethoxy(difluoro)methane
CID 10997218

Frequently Asked Questions

What is the IUPAC name of chloro(difluoro)methane?
The IUPAC name of chloro(difluoro)methane (CID 102425690) is chloro(difluoro)methane.
What is the SMILES notation for chloro(difluoro)methane?
The canonical SMILES for chloro(difluoro)methane is FC(F)[35Cl].
What is the InChIKey of chloro(difluoro)methane?
The InChIKey is VOPWNXZWBYDODV-ULIRUUBJSA-N. The full InChI is InChI=1S/CHClF2/c2-1(3)4/h1H/i2+0.
What are the key properties of chloro(difluoro)methane?
chloro(difluoro)methane has a molecular weight of 85.98 g/mol, XLogP of 1.45, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloro(difluoro)methane is sourced from PubChem (CID 102425690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).