Chemical Properties of 2-Amino-1-phenylethanol, N,O-bis(heptafluorobutyryl)- (CAS 959257-87-5)

2-Amino-1-phenylethanol, N,O-bis(heptafluorobutyryl)-

InChI
InChI=1S/C16H9F14NO3/c17-11(18,13(21,22)15(25,26)27)9(32)31-6-8(7-4-2-1-3-5-7)34-10(33)12(19,20)14(23,24)16(28,29)30/h1-5,8H,6H2,(H,31,32)
InChI Key
NXKYNDOXUWFJJJ-UHFFFAOYSA-N
Formula
C16H9F14NO3
SMILES
O=C(NCC(OC(=O)C(F)(F)C(F)(F)C(F)(F)F)c1ccccc1)C(F)(F)C(F)(F)C(F)(F)F
Molecular Weight1
529.23
CAS
959257-87-5
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Physical Properties

Property Value Unit Source
ω 0.7414 Relay (1.0) Calculated Property
ΔfG° -2789.94 kJ/mol Joback Calculated Property
ΔfH°gas -3405.05 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 35.83 kJ/mol Joback Calculated Property
ΔvapH° 89.73 kJ/mol Relay (1.0) Calculated Property
IE 10.10 eV Relay (1.0) Calculated Property
log10WS -6.67 Relay (1.0) Calculated Property
logPoct/wat 5.053 Crippen Calculated Property
McVol 256.310 ml/mol McGowan Calculated Property
Pc 1267.35 kPa Joback Calculated Property
Inp [1381.00; 1381.00]   Show Hide
Inp 1381.00 NIST
Inp 1381.00 NIST
Tboil 533.96 K Relay (1.0) Calculated Property
Tc 716.94 K Relay (1.0) Calculated Property
Tfus 359.22 K Relay (1.0) Calculated Property
Vc 0.967 m3/kmol Relay (1.0) Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [799.76; 850.06] J/mol×K [742.45; 915.10] Show Hide
Cp,gas 799.76 J/mol×K 742.45 Joback Calculated Property
Cp,gas 810.05 J/mol×K 771.23 Joback Calculated Property
Cp,gas 819.45 J/mol×K 800.00 Joback Calculated Property
Cp,gas 828.05 J/mol×K 828.78 Joback Calculated Property
Cp,gas 835.96 J/mol×K 857.55 Joback Calculated Property
Cp,gas 843.27 J/mol×K 886.33 Joback Calculated Property
Cp,gas 850.06 J/mol×K 915.10 Joback Calculated Property

Similar Compounds

Butanoic acid, heptafluoro-, 4-[2-[(2,2,3,3,4,4,4-heptafluoro-1-oxobutyl)amino]-1-(2,2,3,3,4,4,4-heptafluoro-1-oxobutoxy)ethyl]phenyl ester. (-)-Norepinephrine, N,O,O',O''-tetrakis(heptafluorobutyryl)-. Phenylpropanolamine, N,O-bis(heptafluorobutyryl) deriv.. Octopamine, tri-PFP. (-)-Norepinephrine, N,O,O',O''-tetrakis(pentafluoropropionyl)-. (.+/-.)-Epinephrine, N,O,O',O''-tetrakis(heptafluorobutyryl)-. (-)-Epinephrine, N,O,O',O''-tetrakis(heptafluorobutyryl)-. DL-Metanephrine, N,O,O'-tris(heptafluorobutyryl)-. Ephedrine,N,O-bis(heptafluorobutyryl) deriv.. Tryptophan-leucine-methionine,N(«alpha»,«epsilon»)-trifluoroacetyl-N-O-permethyl derivative. Hypoxanthine-7-ethanol, 2,3-dihydro-3-(diphenylmethyl)-, acetate. Vobassan-17-oic acid, 4-demethyl-3-oxo-, methyl ester. 5-Hydroxy-tetraline-cis-2,3-diol, ferrocenylboronate. AJMALINE, M(NOR-), AC. Codeine.

Find more compounds similar to 2-Amino-1-phenylethanol, N,O-bis(heptafluorobutyryl)-.

Sources

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