Name: Name:tert-butyl 3-(2-chloropyrimidin-4-yl)azetidine-1-carboxylate
Brand: Angene
SKU: AG01B7AU
Rating: 90 (10 reviews)

tert-butyl 3-(2-chloropyrimidin-4-yl)azetidine-1-carboxylate

CAS No.:

1884338-19-5

Catalog Number:

AG01B7AU

Molecular Formula:

C12H16ClN3O2

Molecular Weight:

269.7273

Catalog Number:

AG01B7AU

Chemical Name:

tert-butyl 3-(2-chloropyrimidin-4-yl)azetidine-1-carboxylate

CAS Number:

1884338-19-5

Molecular Formula:

C12H16ClN3O2

Molecular Weight:

269.7273

MDL Number:

MFCD30487203

IUPAC Name:

tert-butyl 3-(2-chloropyrimidin-4-yl)azetidine-1-carboxylate

InChI:

InChI=1S/C12H16ClN3O2/c1-12(2,3)18-11(17)16-6-8(7-16)9-4-5-14-10(13)15-9/h4-5,8H,6-7H2,1-3H3

InChI Key:

MMDSXMCVAPDSFI-UHFFFAOYSA-N

SMILES:

O=C(N1CC(C1)c1ccnc(n1)Cl)OC(C)(C)C

Complexity:

313

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

269.093g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

269.729g/mol

Monoisotopic Mass:

269.093g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9