Name: Name:tert-butyl 2-(aminomethyl)-1,4-oxazepane-4-carboxylate
Brand: Angene
SKU: AG01C1MF
Rating: 90 (10 reviews)

tert-butyl 2-(aminomethyl)-1,4-oxazepane-4-carboxylate

CAS No.:

1184662-18-7

Catalog Number:

AG01C1MF

Molecular Formula:

C11H22N2O3

Molecular Weight:

230.3040

Catalog Number:

AG01C1MF

Chemical Name:

tert-butyl 2-(aminomethyl)-1,4-oxazepane-4-carboxylate

CAS Number:

1184662-18-7

Molecular Formula:

C11H22N2O3

Molecular Weight:

230.3040

MDL Number:

MFCD29047361

IUPAC Name:

tert-butyl 2-(aminomethyl)-1,4-oxazepane-4-carboxylate

InChI:

InChI=1S/C11H22N2O3/c1-11(2,3)16-10(14)13-5-4-6-15-9(7-12)8-13/h9H,4-8,12H2,1-3H3

InChI Key:

YYTTWCYIKQDAMJ-UHFFFAOYSA-N

SMILES:

NCC1OCCCN(C1)C(=O)OC(C)(C)C

Complexity:

238

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

230.163g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

230.308g/mol

Monoisotopic Mass:

230.163g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

64.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.2