Name: Name:3-(tert-butyl)-6-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline
Brand: Angene
SKU: AG01DW0P
Rating: 90 (10 reviews)

3-(tert-butyl)-6-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline

CAS No.:

1406566-96-8

Catalog Number:

AG01DW0P

Molecular Formula:

C14H18F3N

Molecular Weight:

257.2946

Catalog Number:

AG01DW0P

Chemical Name:

3-(tert-butyl)-6-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline

CAS Number:

1406566-96-8

Molecular Formula:

C14H18F3N

Molecular Weight:

257.2946

MDL Number:

MFCD18570892

IUPAC Name:

3-tert-butyl-6-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline

InChI:

InChI=1S/C14H18F3N/c1-13(2,3)11-7-9-6-10(14(15,16)17)4-5-12(9)18-8-11/h4-6,11,18H,7-8H2,1-3H3

InChI Key:

OEJJAFIVOUUAHZ-UHFFFAOYSA-N

SMILES:

CC(C1CNc2c(C1)cc(cc2)C(F)(F)F)(C)C

Complexity:

292

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

257.139g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

257.3g/mol

Monoisotopic Mass:

257.139g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

12A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.8