Name: Name:tert-Butyl 5-chloro-3-oxo-3H-spiro[isobenzofuran-1,4'-piperidine]-1'-carboxylate
Brand: Angene
SKU: AG00GADX
Rating: 90 (10 reviews)

tert-Butyl 5-chloro-3-oxo-3H-spiro[isobenzofuran-1,4'-piperidine]-1'-carboxylate

CAS No.:

849106-20-3

Catalog Number:

AG00GADX

Molecular Formula:

C17H20ClNO4

Molecular Weight:

337.7980

Catalog Number:

AG00GADX

Chemical Name:

tert-Butyl 5-chloro-3-oxo-3H-spiro[isobenzofuran-1,4'-piperidine]-1'-carboxylate

CAS Number:

849106-20-3

Molecular Formula:

C17H20ClNO4

Molecular Weight:

337.7980

MDL Number:

MFCD24849714

IUPAC Name:

tert-butyl 5-chloro-3-oxospiro[2-benzofuran-1,4'-piperidine]-1'-carboxylate

InChI:

InChI=1S/C17H20ClNO4/c1-16(2,3)23-15(21)19-8-6-17(7-9-19)13-5-4-11(18)10-12(13)14(20)22-17/h4-5,10H,6-9H2,1-3H3

InChI Key:

XWDPBBOKRCHLBT-UHFFFAOYSA-N

SMILES:

Clc1ccc2c(c1)C(=O)OC12CCN(CC1)C(=O)OC(C)(C)C

Complexity:

493

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

337.108g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

337.8g/mol

Monoisotopic Mass:

337.108g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.2