Name: Name:tert-butyl 4-(7-bromo-4-oxochroman-2-yl)piperidine-1-carboxylate
Brand: Angene
SKU: AG01DGAS
Rating: 90 (10 reviews)

tert-butyl 4-(7-bromo-4-oxochroman-2-yl)piperidine-1-carboxylate

CAS No.:

2059933-50-3

Catalog Number:

AG01DGAS

Molecular Formula:

C19H24BrNO4

Molecular Weight:

410.3022

Catalog Number:

AG01DGAS

Chemical Name:

tert-butyl 4-(7-bromo-4-oxochroman-2-yl)piperidine-1-carboxylate

CAS Number:

2059933-50-3

Molecular Formula:

C19H24BrNO4

Molecular Weight:

410.3022

MDL Number:

MFCD28992201

IUPAC Name:

tert-butyl 4-(7-bromo-4-oxo-2,3-dihydrochromen-2-yl)piperidine-1-carboxylate

InChI:

InChI=1S/C19H24BrNO4/c1-19(2,3)25-18(23)21-8-6-12(7-9-21)16-11-15(22)14-5-4-13(20)10-17(14)24-16/h4-5,10,12,16H,6-9,11H2,1-3H3

InChI Key:

WWJZLADICMHJGI-UHFFFAOYSA-N

SMILES:

Brc1ccc2c(c1)OC(CC2=O)C1CCN(CC1)C(=O)OC(C)(C)C

Complexity:

510

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

409.089g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

410.308g/mol

Monoisotopic Mass:

409.089g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.8