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1222533-88-1 | 1H-Pyrrolo[2,3-b]pyridine-4-carboxylic acid, 5-(trifluoromethyl)-1-[tris(1-methylethyl)silyl]-
CAS No: 1222533-88-1 Catalog No: AG00170G MDL No:MFCD15530313
Product Description
Catalog Number:
AG00170G
Chemical Name:
1H-Pyrrolo[2,3-b]pyridine-4-carboxylic acid, 5-(trifluoromethyl)-1-[tris(1-methylethyl)silyl]-
CAS Number:
1222533-88-1
Molecular Formula:
C18H25F3N2O2Si
Molecular Weight:
386.4840
MDL Number:
MFCD15530313
IUPAC Name:
5-(trifluoromethyl)-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridine-4-carboxylic acid
InChI:
InChI=1S/C18H25F3N2O2Si/c1-10(2)26(11(3)4,12(5)6)23-8-7-13-15(17(24)25)14(18(19,20)21)9-22-16(13)23/h7-12H,1-6H3,(H,24,25)
InChI Key:
LKEOFBNRUAFEDP-UHFFFAOYSA-N
SMILES:
OC(=O)c1c2ccn(c2ncc1C(F)(F)F)[Si](C(C)C)(C(C)C)C(C)C
Properties
Complexity:
503
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
386.164g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
386.49g/mol
Monoisotopic Mass:
386.164g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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