Chemical Properties of Pyridine, 3-chloro- (CAS 626-60-8)

InChI

InChI=1S/C5H4ClN/c6-5-2-1-3-7-4-5/h1-4H

InChI Key

PWRBCZZQRRPXAB-UHFFFAOYSA-N

Formula

C5H4ClN

SMILES

Clc1cccnc1

Molecular Weight¹

113.55

CAS

626-60-8

Other Names

• m-Chloropyridine
• 3-Chloropyridine
• «beta»-Chloropyridine

• PAff : Proton affinity (kJ/mol).
• BasG : Gas basicity (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
PAff	903.40	kJ/mol	NIST
BasG	871.50	kJ/mol	NIST
ΔvapH°	47.90 ± 1.10	kJ/mol	NIST
IE	[9.10; 9.80]	eV
IE	9.10	eV	NIST
IE	9.80 ± 0.10	eV	NIST
IE	9.65	eV	NIST
IE	9.58	eV	NIST
log10WS	-1.92		Crippen Calculated Property
logPoct/wat	1.735		Crippen Calculated Property
McVol	79.770	ml/mol	McGowan Calculated Property
Inp	[861.10; 890.00]
Inp	884.50		NIST
Inp	885.00		NIST
Inp	887.00		NIST
Inp	890.00		NIST
Inp	Outlier 861.10		NIST
Inp	890.00		NIST
Inp	890.00		NIST
Tboil	421.20	K	NIST

Similar Compounds

Find more compounds similar to Pyridine, 3-chloro-.

Sources

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

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.