3-Bodipy-propanoic Acid Methyl Ester

Catalog Number

ACM1242057006

CAS

1242057-00-6

Structure

IUPAC Name

Methyl3-(2,2-difluoro-10,12-dimethyl-1-aza-3-azonia-2-boranuidatricyclo[7.3.0.03,7]dodeca-3,5,7,9,11-pentaen-4-yl)propanoate

Molecular Weight

306.11

Molecular Formula

C15H17BF2N2O2

Canonical SMILES

[B-]1(N2C(=CC(=C2C=C3[N+]1=C(C=C3)CCC(=O)OC)C)C)(F)F

InChI

InChI=1S/C15H17BF2N2O2/c1-10-8-11(2)19-14(10)9-13-5-4-12(6-7-15(21)22-3)20(13)16(19,17)18/h4-5,8-9H,6-7H2,1-3H3

InChI Key

YKZNONDRHXQSKM-UHFFFAOYSA-N

Melting Point

76 - 78 °C

Purity

98%

• Catalog Number: ACM1242057006
• CAS: 1242057-00-6
• IUPAC Name: Methyl3-(2,2-difluoro-10,12-dimethyl-1-aza-3-azonia-2-boranuidatricyclo[7.3.0.03,7]dodeca-3,5,7,9,11-pentaen-4-yl)propanoate
• Molecular Weight: 306.11
• Molecular Formula: C15H17BF2N2O2
• Canonical SMILES: [B-]1(N2C(=CC(=C2C=C3[N+]1=C(C=C3)CCC(=O)OC)C)C)(F)F
• InChI: InChI=1S/C15H17BF2N2O2/c1-10-8-11(2)19-14(10)9-13-5-4-12(6-7-15(21)22-3)20(13)16(19,17)18/h4-5,8-9H,6-7H2,1-3H3
• InChI Key: YKZNONDRHXQSKM-UHFFFAOYSA-N
• Melting Point: 76 - 78 °C
• Purity: 98%