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1-Chloro-1,1,2,2,3-pentafluoropropane

HCID 69613
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Basic information

CAS
677-55-4
Standard SMILES
FCC(F)(F)C(F)(F)Cl
InChIKey
UHMWWIKRVZTBBR-UHFFFAOYSA-N
Molecular formula
C3H2ClF5
Average molar mass
168.49 g/mol
Monoisotopic mass
167.9765186

Names & identifiers

Preferred name
1-Chloro-1,1,2,2,3-pentafluoropropane
IUPAC
1-chloro-1,1,2,2,3-pentafluoropropane
English name
1-Chloro-1,1,3,3,3-pentafluoropropane
Molecular formula
C3H2ClF5
Molecular weight
168.49

Names & synonyms

1-Chloro-1,1,2,2,3-pentafluoropropaneBRN 1815888677-55-4Propane, 1-chloro-1,1,2,2,3-pentafluoro-6U57777Z51DTXSID20987046UNII-6U57777Z51RefChem:75303DTXCID001414218HCFC-235ccSCHEMBL652263UHMWWIKRVZTBBR-UHFFFAOYSA-N
Show more names
Q27265525

Database identifiers

CAS
677-55-4
PubChem CID
69613
DTXSID
DTXSID20987046
UNII
6U57777Z51
Nikkaji
J50.729F

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
2
Heavy atoms
9
Formal charge
0
Complexity
100

Physicochemical properties

Boiling point
28.35 °C · 28.35°C
Density
1.1948 · 1.1948 (estimate)
refractive index
1.2457 · 1.2457 (estimate)
FDA UNII
6 U57777Z51 · 6U57777Z51
EPA Substance Registry System
-235 cc · HCFC-235cc (677-55-4)

Related reactions

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Compound notes

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