CAS 148043-73-6|4,4,5,5,5-Pentafluoro-1-pentanol|4,4,5,5,5-pentafluoropentan-1-ol|4,4,5,5,5-pentafluoropentan-1-ol|4,4,5,5,5-Pentafluoropentan-1-ol|3-(Perfluoroethyl)propan-1-ol|5-Hydroxy-1,1,1,2,2-...

General Information

Structure

Molecular Formula

C₅H₇F₅O

Molecular Mass

178.100496

Exact Mass

178.04170594

Charge

InChI

InChI=1S/C5H7F5O/c6-4(7,2-1-3-11)5(8,9)10/h11H,1-3H2

InChIKey

QROUUECTKRZFHF-UHFFFAOYSA-N

Canonic Smiles

OCCCC(C(F)(F)F)(F)F

Isomeric Smiles

C(C(CCCO)(F)F)(F)(F)F

Calculated Properties

JChem

Acid pKa

15.963685

H Acceptors

H Donor

LogD (pH = 5.5)

1.4857829

LogD (pH = 7.4)

1.4857829

Log P

1.4857829

Molar Refractivity

27.9998

Polarizability

10.225439

Polar Surface Area

20.23

Rotatable Bonds

Lipinski's Rule of Five

true

Data Source

Names and Identifiers

Synonyms

4,4,5,5,5-Pentafluoro-1-pentanol4,4,5,5,5-Pentafluoropentan-1-ol3-(Perfluoroethyl)propan-1-ol5-Hydroxy-1,1,1,2,2-pentafluoropentane4,4,5,5,5-Pentafluoro-1-pentanol4,4,5,5,5-Pentafluoropentanol4,4,5,5,5-Pentafluoro-1-pentanol4,4,5,5,5-五氟-1-戊醇4,4,5,5,5-Pentafluoropentanol4,4,5,5,5-五氟戊醇

IUPAC name

4,4,5,5,5-pentafluoropentan-1-ol

IUPAC Traditional name

4,4,5,5,5-pentafluoropentan-1-ol

Names and Identifiers

Registration numbers

PubChem CID

547967

PubChem SID

16097008124878519

MDL Number

MFCD00153224