3,3'-[7,12-Bis(1-hydroxyethyl)-3,8,13,17-tetramethyl-2,18-porphyrindiyl]dipropanoic acid dihydrochloride
[CAS# 7779-81-9]

Identification

• Classification: Flavors and spices >> Synthetic spice >> Carboxylic acid and ester perfume >> Aliphatic carboxylate
• Name: 3,3'-[7,12-Bis(1-hydroxyethyl)-3,8,13,17-tetramethyl-2,18-porphyrindiyl]dipropanoic acid dihydrochloride
• Synonyms: 2,18-Porphinedipropionic acid, 7,12-bis(1-hydroxyethyl)-3,8,13,17-tetramethyl-, dihydrochloride; 21H,23H-Porphine-2,18-dipropanoic acid, 7,12-bis(1-hydroxyethyl)-3,8,13,17-tetramethyl-, dihydrochloride; 7,12-BIS(1-HYDROXYETHYL)-3,8,13,17-TETRAMETHYL-2,18- PORPHINEDIPROPIONIC ACID DIHYDROCHLORIDE
• Molecular Formula: C₃₄H₄₀Cl₂N₄O₆
• Molecular Weight: 671.61
• CAS Registry Number: 7779-81-9
• EINECS: 231-941-7
• FEMA: 2180
• SMILES: CC1=C(C2=CC3=NC(=CC4=C(C(=C(N4)C=C5C(=C(C(=N5)C=C1N2)C(C)O)C)C(C)O)C)C(=C3CCC(=O)O)C)CCC(=O)O.Cl.Cl
• InChI: 1S/C34H38N4O6.2ClH/c1-15-21(7-9-31(41)42)27-14-28-22(8-10-32(43)44)16(2)24(36-28)12-29-34(20(6)40)18(4)26(38-29)13-30-33(19(5)39)17(3)25(37-30)11-23(15)35-27;;/h11-14,19-20,36-37,39-40H,7-10H2,1-6H3,(H,41,42)(H,43,44);2*1H/b23-11-,24-12-,25-11-,26-13-,27-14-,28-14-,29-12-,30-13-
• InChIKey: QCLJGYHFHNRFIL-UDHHKLSBSA-N

Safety Data

• Safety Description: CAUTION: May be harmful if swallowed