4-(1-Pyrrolyl)benzoic acid

Modify Date: 2024-01-08 17:49:48

4-(1-Pyrrolyl)benzoic acid Structure
4-(1-Pyrrolyl)benzoic acid structure
Common Name 4-(1-Pyrrolyl)benzoic acid
CAS Number 22106-33-8 Molecular Weight 187.19500
Density 1.18g/cm3 Boiling Point 355.5ºC at 760mmHg
Molecular Formula C11H9NO2 Melting Point 286-289 °C(lit.)
MSDS N/A Flash Point 168.8ºC

 Names

Name 4-(1H-Pyrrol-1-yl)benzoic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.18g/cm3
Boiling Point 355.5ºC at 760mmHg
Melting Point 286-289 °C(lit.)
Molecular Formula C11H9NO2
Molecular Weight 187.19500
Flash Point 168.8ºC
Exact Mass 187.06300
PSA 42.23000
LogP 2.17550
Vapour Pressure 1.14E-05mmHg at 25°C

 Safety Information

Hazard Codes Xi: Irritant;
Risk Phrases R36/37/38
Safety Phrases S26-S37/39
WGK Germany 3
HS Code 2933990090

 Synthetic Route

~70%

4-(1-Pyrrolyl)benzoic acid Structure

4-(1-Pyrrolyl)b...

CAS#:22106-33-8

Literature: Panda, Niranjan; Jena, Ashis Kumar; Mohapatra, Sasmita; Rout, Smruti Ranjan Tetrahedron Letters, 2011 , vol. 52, # 16 p. 1924 - 1927

~66%

4-(1-Pyrrolyl)benzoic acid Structure

4-(1-Pyrrolyl)b...

CAS#:22106-33-8

Literature: Liu, Kun; Lu, Hong; Hou, Ling; Qi, Zhi; Teixeira, Catia; Barbault, Florent; Fan, Bo-Tao; Liu, Shuwen; Jiang, Shibo; Xie, Lan Journal of Medicinal Chemistry, 2008 , vol. 51, # 24 p. 7843 - 7854

~%

4-(1-Pyrrolyl)benzoic acid Structure

4-(1-Pyrrolyl)b...

CAS#:22106-33-8

Literature: Journal of the Chemical Society. Perkin Transactions 1, , # 9 p. 1039 - 1043

~%

4-(1-Pyrrolyl)benzoic acid Structure

4-(1-Pyrrolyl)b...

CAS#:22106-33-8

Literature: Journal of the Chemical Society. Perkin Transactions 1, , # 9 p. 1039 - 1043

 Customs

HS Code 2933990090
Summary 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

4-pyrrol-1-ylbenzoic acid
MFCD00082569