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121983-02-6 | Quinoline, 1,2-dihydro-2,2,4-trimethyl-6-(triphenylmethyl)-
CAS No: 121983-02-6 Catalog No: AG0016I0 MDL No:
Product Description
Catalog Number:
AG0016I0
Chemical Name:
Quinoline, 1,2-dihydro-2,2,4-trimethyl-6-(triphenylmethyl)-
CAS Number:
121983-02-6
Molecular Formula:
C31H29N
Molecular Weight:
415.5687
IUPAC Name:
2,2,4-trimethyl-6-trityl-1H-quinoline
InChI:
InChI=1S/C31H29N/c1-23-22-30(2,3)32-29-20-19-27(21-28(23)29)31(24-13-7-4-8-14-24,25-15-9-5-10-16-25)26-17-11-6-12-18-26/h4-22,32H,1-3H3
InChI Key:
PTFCOZWCSXQOEY-UHFFFAOYSA-N
SMILES:
CC1=CC(C)(C)Nc2c1cc(cc2)C(c1ccccc1)(c1ccccc1)c1ccccc1
Properties
Complexity:
596
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
415.23g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
415.58g/mol
Monoisotopic Mass:
415.23g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.8
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