Name: Name:tert-butyl 6-bromo-3,4-dihydrospiro[1-benzopyran-2,4'-piperidine]-1'-carboxylate
Brand: Angene
SKU: AG01C4X2
Rating: 90 (10 reviews)

tert-butyl 6-bromo-3,4-dihydrospiro[1-benzopyran-2,4'-piperidine]-1'-carboxylate

CAS No.:

1194374-64-5

Catalog Number:

AG01C4X2

Molecular Formula:

C18H24BrNO3

Molecular Weight:

382.2921

Catalog Number:

AG01C4X2

Chemical Name:

tert-butyl 6-bromo-3,4-dihydrospiro[1-benzopyran-2,4'-piperidine]-1'-carboxylate

CAS Number:

1194374-64-5

Molecular Formula:

C18H24BrNO3

Molecular Weight:

382.2921

MDL Number:

MFCD11227132

IUPAC Name:

tert-butyl 6-bromospiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxylate

InChI:

InChI=1S/C18H24BrNO3/c1-17(2,3)23-16(21)20-10-8-18(9-11-20)7-6-13-12-14(19)4-5-15(13)22-18/h4-5,12H,6-11H2,1-3H3

InChI Key:

NZSBMAJIONQUET-UHFFFAOYSA-N

SMILES:

Brc1ccc2c(c1)CCC1(O2)CCN(CC1)C(=O)OC(C)(C)C

Complexity:

440

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

381.094g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

382.298g/mol

Monoisotopic Mass:

381.094g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

38.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.2