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Reference substances

Reference substances

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Reference substance information

IUPAC name:
2,6-bis({[bis(2-hydroxyethyl)amino]methyl})-4-[2-(3-{[bis(2-hydroxyethyl)amino]methyl}-4-hydroxyphenyl)propan-2-yl]phenol; 2,6-bis({[bis(2-hydroxyethyl)amino]methyl})-4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 2-[(2-hydroxyethyl)amino]ethan-1-ol; 2-{[bis(2-hydroxyethyl)amino]methyl}-4-[2-(3-{[bis(2-hydroxyethyl)amino]methyl}-4-hydroxyphenyl)propan-2-yl]phenol; 2-{[bis(2-hydroxyethyl)amino]methyl}-4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol

Molecular and structural information

Molecular formula:
C4H11NO2 C15H16O2 C20H27NO4 C25H38N2O6 C30H49N3O8
Molecular weight:
354
SMILES notation:
OCCNCCO.CC(C)(C1=CC=C(O)C=C1)C1=CC(CN(CCO)CCO)=C(O)C=C1.CC(C)(c1ccc(O)cc1)c2ccc(O)cc2.CC(C)(C1=CC(CN(CCO)CCO)=C(O)C=C1)C1=CC(CN(CCO)CCO)=C(O)C=C1.C1(O)C(CN(CCO)CCO)=CC(=CC=1CN(CCO)CCO)C(C)(C(=CC=C1O)C=C1)C.CC(C)(C1=CC=C(O)C(CN(CCO)CCO)=C1)C1=CC(CN(CCO)CCO)=C(O)C(CN(CCO)CCO)=C1
InChl:
InChI=1S/C30H49N3O8.2C25H38N2O6.C20H27NO4.C15H16O2.C4H11NO2/c1-30(2,26-3-4-28(40)23(17-26)20-31(5-11-34)6-12-35)27-18-24(21-32(7-13-36)8-14-37)29(41)25(19-27)22-33(9-15-38)10-16-39;1-25(2,21-3-5-23(32)19(15-21)17-26(7-11-28)8-12-29)22-4-6-24(33)20(16-22)18-27(9-13-30)10-14-31;1-25(2,21-3-5-23(32)6-4-21)22-15-19(17-26(7-11-28)8-12-29)24(33)20(16-22)18-27(9-13-30)10-14-31;1-20(2,16-3-6-18(24)7-4-16)17-5-8-19(25)15(13-17)14-21(9-11-22)10-12-23;1-15(2,11-3-7-13(16)8-4-11)12-5-9-14(17)10-6-12;6-3-1-5-2-4-7/h3-4,17-19,34-41H,5-16,20-22H2,1-2H3;2*3-6,15-16,28-33H,7-14,17-18H2,1-2H3;3-8,13,22-25H,9-12,14H2,1-2H3;3-10,16-17H,1-2H3;5-7H,1-4H2
Structural formula:
Chemical structure