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Home > Indoles and Oxindole > 88972-95-6
88972-95-6 | Phenol, 2,6-bis(1,1-dimethylethyl)-4-(6-methoxy-3-methyl-1H-indol-2-yl)-
CAS No: 88972-95-6 Catalog No: AG0045BX MDL No:
Product Description
Catalog Number:
AG0045BX
Chemical Name:
Phenol, 2,6-bis(1,1-dimethylethyl)-4-(6-methoxy-3-methyl-1H-indol-2-yl)-
CAS Number:
88972-95-6
Molecular Formula:
C24H31NO2
Molecular Weight:
365.5084
IUPAC Name:
2,6-ditert-butyl-4-(6-methoxy-3-methyl-1H-indol-2-yl)phenol
InChI:
InChI=1S/C24H31NO2/c1-14-17-10-9-16(27-8)13-20(17)25-21(14)15-11-18(23(2,3)4)22(26)19(12-15)24(5,6)7/h9-13,25-26H,1-8H3
InChI Key:
NWRMAAPNFZXFPX-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)[nH]c(c2C)c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C
Properties
Complexity:
482
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
365.235g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
365.517g/mol
Monoisotopic Mass:
365.235g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
45.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7
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