Name: Name:tert-butyl 6-fluoro-6-methyl-1,4-diazepane-1-carboxylate
Brand: Angene
SKU: AG01AN3I
Rating: 90 (10 reviews)

tert-butyl 6-fluoro-6-methyl-1,4-diazepane-1-carboxylate

CAS No.:

1780650-28-3

Catalog Number:

AG01AN3I

Molecular Formula:

C11H21FN2O2

Molecular Weight:

232.2950

Catalog Number:

AG01AN3I

Chemical Name:

tert-butyl 6-fluoro-6-methyl-1,4-diazepane-1-carboxylate

CAS Number:

1780650-28-3

Molecular Formula:

C11H21FN2O2

Molecular Weight:

232.2950

MDL Number:

MFCD28544157

IUPAC Name:

tert-butyl 6-fluoro-6-methyl-1,4-diazepane-1-carboxylate

InChI:

InChI=1S/C11H21FN2O2/c1-10(2,3)16-9(15)14-6-5-13-7-11(4,12)8-14/h13H,5-8H2,1-4H3

InChI Key:

INRMUIJBJHNDML-UHFFFAOYSA-N

SMILES:

O=C(N1CCNCC(C1)(C)F)OC(C)(C)C

Complexity:

265

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

232.159g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

232.299g/mol

Monoisotopic Mass:

232.159g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

41.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.1