Benzoic acid, 4-[3-(2-benzofuranyl)-5,6,7,8-tetrahydropyrazolo[3,4-b]azepin-1(4H)-yl]- (9CI)

Modify Date: 2025-08-25 17:00:01

Benzoic acid, 4-[3-(2-benzofuranyl)-5,6,7,8-tetrahydropyrazolo[3,4-b]azepin-1(4H)-yl]- (9CI) Structure
Benzoic acid, 4-[3-(2-benzofuranyl)-5,6,7,8-tetrahydropyrazolo[3,4-b]azepin-1(4H)-yl]- (9CI) structure
Common Name Benzoic acid, 4-[3-(2-benzofuranyl)-5,6,7,8-tetrahydropyrazolo[3,4-b]azepin-1(4H)-yl]- (9CI)
CAS Number 583021-12-9 Molecular Weight 373.405
Density 1.4±0.1 g/cm3 Boiling Point 634.7±55.0 °C at 760 mmHg
Molecular Formula C22H19N3O3 Melting Point N/A
MSDS N/A Flash Point 337.7±31.5 °C

 Names

Name 4-[3-(1-Benzofuran-2-yl)-5,6,7,8-tetrahydropyrazolo[3,4-b]azepin-1(4H)-yl]benzoic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.4±0.1 g/cm3
Boiling Point 634.7±55.0 °C at 760 mmHg
Molecular Formula C22H19N3O3
Molecular Weight 373.405
Flash Point 337.7±31.5 °C
Exact Mass 373.142639
LogP 5.83
Vapour Pressure 0.0±2.0 mmHg at 25°C
Index of Refraction 1.716
InChIKey XAMKYLDAYUGTLA-UHFFFAOYSA-N
SMILES O=C(O)c1ccc(-n2nc(-c3cc4ccccc4o3)c3c2NCCCC3)cc1

 Synonyms

Benzoic acid, 4-[3-(2-benzofuranyl)-5,6,7,8-tetrahydropyrazolo[3,4-b]azepin-1(4H)-yl]-
4-[3-(1-Benzofuran-2-yl)-5,6,7,8-tetrahydropyrazolo[3,4-b]azepin-1(4H)-yl]benzoic acid
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