Chemical Properties of Benzamide, 3-bromo-N-(hept-2-yl)-

InChI

InChI=1S/C14H20BrNO/c1-3-4-5-7-11(2)16-14(17)12-8-6-9-13(15)10-12/h6,8-11H,3-5,7H2,1-2H3,(H,16,17)

InChI Key

HUXXLRPTXAKIIZ-UHFFFAOYSA-N

Formula

C14H20BrNO

SMILES

CCCCCC(C)N=C(O)c1cccc(Br)c1

Molecular Weight¹

298.22

• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	-165.98	kJ/mol	Joback Calculated Property
ΔvapH°	75.82	kJ/mol	Joback Calculated Property
log10WS	-5.15		Crippen Calculated Property
logPoct/wat	4.723		Crippen Calculated Property
McVol	213.410	ml/mol	McGowan Calculated Property
Pc	2110.00	kPa	Joback Calculated Property
Inp	[2124.00; 2124.00]
Inp	2124.00		NIST
Inp	2124.00		NIST
Tboil	785.84	K	Joback Calculated Property
Tc	1000.15	K	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzamide, 3-bromo-N-(hept-2-yl)-.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.