BDPFL azide

Catalog Number

ACM1379771955-1

CAS

1379771-95-5

Synonyms

7-(3-((3-Azidopropyl)amino)-3-oxopropyl)-5,5-difluoro-1,3-dimethyl-5H-dipyrrolo[1,2-c:2',1'-f][1,3,2]diazaborinin-4-ium-5-uide

IUPAC Name

N-(3-azidopropyl)-3-(2,2-difluoro-10,12-dimethyl-3-aza-1-azonia-2-boranuidatricyclo[7.3.0.03,7]dodeca-1(12),4,6,8,10-pentaen-4-yl)propanamide

Molecular Weight

374.2

Molecular Formula

C17H21BF2N6O

Canonical SMILES

[B-]1(N2C(=CC=C2CCC(=O)NCCCN=[N+]=[N-])C=C3[N+]1=C(C=C3C)C)(F)F

InChI

InChI=1S/C17H21BF2N6O/c1-12-10-13(2)25-16(12)11-15-5-4-14(26(15)18(25,19)20)6-7-17(27)22-8-3-9-23-24-21/h4-5,10-11H,3,6-9H2,1-2H3,(H,22,27)

InChI Key

IKOHTCNDGJLUHG-UHFFFAOYSA-N

Purity

96%

Storage

-20 °C in the dark

• Catalog Number: ACM1379771955-1
• CAS: 1379771-95-5
• Synonyms: 7-(3-((3-Azidopropyl)amino)-3-oxopropyl)-5,5-difluoro-1,3-dimethyl-5H-dipyrrolo[1,2-c:2',1'-f][1,3,2]diazaborinin-4-ium-5-uide
• IUPAC Name: N-(3-azidopropyl)-3-(2,2-difluoro-10,12-dimethyl-3-aza-1-azonia-2-boranuidatricyclo[7.3.0.03,7]dodeca-1(12),4,6,8,10-pentaen-4-yl)propanamide
• Molecular Weight: 374.2
• Molecular Formula: C17H21BF2N6O
• Canonical SMILES: [B-]1(N2C(=CC=C2CCC(=O)NCCCN=[N+]=[N-])C=C3[N+]1=C(C=C3C)C)(F)F
• InChI: InChI=1S/C17H21BF2N6O/c1-12-10-13(2)25-16(12)11-15-5-4-14(26(15)18(25,19)20)6-7-17(27)22-8-3-9-23-24-21/h4-5,10-11H,3,6-9H2,1-2H3,(H,22,27)
• InChI Key: IKOHTCNDGJLUHG-UHFFFAOYSA-N
• Purity: 96%
• Storage: -20 °C in the dark