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10008-88-5 | Phenol, 4,4'-(1-methylethylidene)bis[2-[(diethylamino)methyl]-
CAS No: 10008-88-5 Catalog No: AG0000US MDL No:
Product Description
Catalog Number:
AG0000US
Chemical Name:
Phenol, 4,4'-(1-methylethylidene)bis[2-[(diethylamino)methyl]-
CAS Number:
10008-88-5
Molecular Formula:
C25H38N2O2
Molecular Weight:
398.5814
IUPAC Name:
2-(diethylaminomethyl)-4-[2-[3-(diethylaminomethyl)-4-hydroxyphenyl]propan-2-yl]phenol
InChI:
InChI=1S/C25H38N2O2/c1-7-26(8-2)17-19-15-21(11-13-23(19)28)25(5,6)22-12-14-24(29)20(16-22)18-27(9-3)10-4/h11-16,28-29H,7-10,17-18H2,1-6H3
InChI Key:
DJDPRXQQLVKIER-UHFFFAOYSA-N
SMILES:
CCN(Cc1cc(ccc1O)C(c1ccc(c(c1)CN(CC)CC)O)(C)C)CC
Properties
Complexity:
422
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
398.293g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
398.591g/mol
Monoisotopic Mass:
398.293g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
46.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
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