Chemical Properties of 1H-Pyrrole, 2-phenyl- (CAS 3042-22-6)

InChI

InChI=1S/C10H9N/c1-2-5-9(6-3-1)10-7-4-8-11-10/h1-8,11H

InChI Key

IRTLROCMFSDSNF-UHFFFAOYSA-N

Formula

C10H9N

SMILES

c1ccc(-c2ccc[nH]2)cc1

Molecular Weight¹

143.19

CAS

3042-22-6

Other Names

• Pyrrole, 2-phenyl-
• 2-Phenylpyrrole

• Δ_cH°_solid : Standard solid enthalpy of combustion (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔcH°solid	-5360.50 ± 5.40	kJ/mol	NIST
log10WS	-3.29		Crippen Calculated Property
logPoct/wat	2.200		Crippen Calculated Property
McVol	118.520	ml/mol	McGowan Calculated Property
Tfus	[403.00; 403.00]	K
Tfus	403.00 ± 2.00	K	NIST
Tfus	403.00 ± 2.00	K	NIST

Similar Compounds

Find more compounds similar to 1H-Pyrrole, 2-phenyl-.

Sources

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

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