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89490-60-8 | Methanone, bis[2,4-bis(1,1-dimethylethyl)phenyl]-
CAS No: 89490-60-8 Catalog No: AG0041IZ MDL No:
Product Description
Catalog Number:
AG0041IZ
Chemical Name:
Methanone, bis[2,4-bis(1,1-dimethylethyl)phenyl]-
CAS Number:
89490-60-8
Molecular Formula:
C29H42O
Molecular Weight:
406.6432
IUPAC Name:
bis(2,4-ditert-butylphenyl)methanone
InChI:
InChI=1S/C29H42O/c1-26(2,3)19-13-15-21(23(17-19)28(7,8)9)25(30)22-16-14-20(27(4,5)6)18-24(22)29(10,11)12/h13-18H,1-12H3
InChI Key:
QJHHYZMEMGPYJP-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1C(C)(C)C)C(C)(C)C)c1ccc(cc1C(C)(C)C)C(C)(C)C
Properties
Complexity:
534
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
406.324g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
406.654g/mol
Monoisotopic Mass:
406.324g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
10
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