7-AZAINDOLE-3-CARBOXALDEHYDE

CAS

4649-09-6

Catalog Number

ACM4649096

Category

Other Products

Molecular Weight

146.15

Molecular Formula

C8H6N2O

MSDS COA Spec Sheet

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Specification

Synonyms

7-Azaindole-3-carboxaldehyde, MLS000756382, NSC173969, ALBB-007806, 1H-Pyrrolo[2,3-b]pyridine-3-carbaldehyde, CID5372812, SL-02001, SMR000528706, 4649-09-6

IUPAC Name

1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde

Canonical SMILES

C1=CC2=C(NC=C2C=O)N=C1

InChI Key

KAIWRKYDYWYFIT-UHFFFAOYSA-N

Boiling Point

361.1ºC at 760 mmHg

Melting Point

216-220ºC

Flash Point

176ºC

Density

1.368 g/cm³

Exact Mass

146.04800

Hazard Statements

H-Bond Acceptor

H-Bond Donor

Safety Description

26-36/37

Upstream Synthesis Route 1

271-63-6
64-19-7

4649-09-6

Reference: [1] Journal of Medicinal Chemistry, 2014, vol. 57, # 18, p. 7577 - 7589
[2] Patent: US2006/84674, 2006, A1, . Location in patent: Page/Page column 7
[3] Patent: US2004/224973, 2004, A1, . Location in patent: Page 32
[4] Chinese Chemical Letters, 2010, vol. 21, # 3, p. 297 - 300
[5] Patent: US2012/245178, 2012, A1, . Location in patent: Page/Page column 12

Upstream Synthesis Route 2

271-63-6
68-12-2

4649-09-6

Reference: [1] Tetrahedron Letters, 2012, vol. 53, # 17, p. 2222 - 2225

Upstream Synthesis Route 3

271-63-6
68-12-2

4649-09-6

Reference: [1]Tetrahedron Letters,2012,vol. 53,p. 2222 - 2225

Downstream Synthesis Route 1

4649-09-6

5654-93-3

Reference: [1] Journal of Physical Chemistry A, 2002, vol. 106, # 35, p. 8006 - 8012

Downstream Synthesis Route 2

4649-09-6
24424-99-5

144657-66-9

Reference: [1]Patent: WO2011/23081,2011,A1 .Location in patent: Page/Page column 55

Downstream Synthesis Route 3

4649-09-6
98-09-9

155819-08-2

Reference: [1]Tetrahedron,2010,vol. 66,p. 1827 - 1831
[2]Tetrahedron Letters,1999,vol. 40,p. 5853 - 5854
[3]Patent: WO2007/98418,2007,A1 .Location in patent: Page/Page column 116-117
[4]Chinese Chemical Letters,2010,vol. 21,p. 297 - 300

* For details of the synthesis route, please refer to the original source to ensure accuracy.

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