Name: Name:2,7-Diazaspiro[3.5]nonane-7-carboxylic acid, 5,5-difluoro-, 1,1-dimethylethyl ester
Brand: Angene
SKU: AG000JMR
Rating: 90 (10 reviews)

2,7-Diazaspiro[3.5]nonane-7-carboxylic acid, 5,5-difluoro-, 1,1-dimethylethyl ester

CAS No.:

1228631-69-3

Catalog Number:

AG000JMR

Molecular Formula:

C12H20F2N2O2

Molecular Weight:

262.2962

Catalog Number:

AG000JMR

Chemical Name:

2,7-Diazaspiro[3.5]nonane-7-carboxylic acid, 5,5-difluoro-, 1,1-dimethylethyl ester

CAS Number:

1228631-69-3

Molecular Formula:

C12H20F2N2O2

Molecular Weight:

262.2962

MDL Number:

MFCD14581448

IUPAC Name:

tert-butyl 5,5-difluoro-2,7-diazaspiro[3.5]nonane-7-carboxylate

InChI:

InChI=1S/C12H20F2N2O2/c1-10(2,3)18-9(17)16-5-4-11(6-15-7-11)12(13,14)8-16/h15H,4-8H2,1-3H3

InChI Key:

DPKMOHMENJEEJV-UHFFFAOYSA-N

SMILES:

O=C(N1CCC2(C(C1)(F)F)CNC2)OC(C)(C)C

Complexity:

349

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

262.149g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

262.301g/mol

Monoisotopic Mass:

262.149g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

41.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.4