Pyroporphyrin dimethyl ester

Catalog Number

ACM10589943-1

CAS

10589-94-3

Structure

Synonyms

DeuteroporphyrinI X

IUPAC Name

Methyl3-[18-(3-methoxy-3-oxopropyl)-3,8,13,17-tetramethyl-22,23-dihydroporphyrin-2-yl]propanoate

Molecular Weight

538.64

Molecular Formula

C32H34N4O4

Canonical SMILES

CC1=CC2=CC3=C(C=C(N3)C=C4C(=C(C(=N4)C=C5C(=C(C(=N5)C=C1N2)C)CCC(=O)OC)CCC(=O)OC)C)C

InChI

InChI=1S/C32H34N4O4/c1-17-11-22-14-27-19(3)23(7-9-31(37)39-5)29(35-27)16-30-24(8-10-32(38)40-6)20(4)28(36-30)15-26-18(2)12-21(34-26)13-25(17)33-22/h11-16,33-34H,7-10H2,1-6H3

InChI Key

CEPCOHFDZYMQHP-UHFFFAOYSA-N

Boiling Point

996.4 ± 65.0 °C

Melting Point

217 - 220 °C

Purity

90%

Density

1.226 ± 0.06 g/ml

Appearance

Purple crystal

Storage

-20 °C

• Catalog Number: ACM10589943-1
• CAS: 10589-94-3
• Synonyms: DeuteroporphyrinI X
• IUPAC Name: Methyl3-[18-(3-methoxy-3-oxopropyl)-3,8,13,17-tetramethyl-22,23-dihydroporphyrin-2-yl]propanoate
• Molecular Weight: 538.64
• Molecular Formula: C32H34N4O4
• Canonical SMILES: CC1=CC2=CC3=C(C=C(N3)C=C4C(=C(C(=N4)C=C5C(=C(C(=N5)C=C1N2)C)CCC(=O)OC)CCC(=O)OC)C)C
• InChI: InChI=1S/C32H34N4O4/c1-17-11-22-14-27-19(3)23(7-9-31(37)39-5)29(35-27)16-30-24(8-10-32(38)40-6)20(4)28(36-30)15-26-18(2)12-21(34-26)13-25(17)33-22/h11-16,33-34H,7-10H2,1-6H3
• InChI Key: CEPCOHFDZYMQHP-UHFFFAOYSA-N
• Boiling Point: 996.4 ± 65.0 °C
• Melting Point: 217 - 220 °C
• Purity: 90%
• Density: 1.226 ± 0.06 g/ml
• Appearance: Purple crystal
• Storage: -20 °C