Name: Name:tert-butyl 6-bromo-1,2,3,4-tetrahydroquinoline-4-carboxylate
Brand: Angene
SKU: AG01B6FC
Rating: 90 (10 reviews)

tert-butyl 6-bromo-1,2,3,4-tetrahydroquinoline-4-carboxylate

CAS No.:

2059938-18-8

Catalog Number:

AG01B6FC

Molecular Formula:

C14H18BrNO2

Molecular Weight:

312.2022

Catalog Number:

AG01B6FC

Chemical Name:

tert-butyl 6-bromo-1,2,3,4-tetrahydroquinoline-4-carboxylate

CAS Number:

2059938-18-8

Molecular Formula:

C14H18BrNO2

Molecular Weight:

312.2022

MDL Number:

MFCD30497507

IUPAC Name:

tert-butyl 6-bromo-1,2,3,4-tetrahydroquinoline-4-carboxylate

InChI:

InChI=1S/C14H18BrNO2/c1-14(2,3)18-13(17)10-6-7-16-12-5-4-9(15)8-11(10)12/h4-5,8,10,16H,6-7H2,1-3H3

InChI Key:

KNSSXPAAXKJIFJ-UHFFFAOYSA-N

SMILES:

O=C(C1CCNc2c1cc(Br)cc2)OC(C)(C)C

Complexity:

313

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

311.052g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

312.207g/mol

Monoisotopic Mass:

311.052g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

38.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.5