Name: Name:tert-butyl 3-[(2E)-3-(dimethylamino)prop-2-enoyl]azetidine-1-carboxylate
Brand: Angene
SKU: AG01BIDB
Rating: 90 (10 reviews)

tert-butyl 3-[(2E)-3-(dimethylamino)prop-2-enoyl]azetidine-1-carboxylate

CAS No.:

1236861-77-0

Catalog Number:

AG01BIDB

Molecular Formula:

C13H22N2O3

Molecular Weight:

254.3254

Catalog Number:

AG01BIDB

Chemical Name:

tert-butyl 3-[(2E)-3-(dimethylamino)prop-2-enoyl]azetidine-1-carboxylate

CAS Number:

1236861-77-0

Molecular Formula:

C13H22N2O3

Molecular Weight:

254.3254

MDL Number:

MFCD28401439

IUPAC Name:

tert-butyl 3-[3-(dimethylamino)prop-2-enoyl]azetidine-1-carboxylate

InChI:

InChI=1S/C13H22N2O3/c1-13(2,3)18-12(17)15-8-10(9-15)11(16)6-7-14(4)5/h6-7,10H,8-9H2,1-5H3

InChI Key:

GRZRDEFGROCFOZ-UHFFFAOYSA-N

SMILES:

CN(/C=C/C(=O)C1CN(C1)C(=O)OC(C)(C)C)C

Complexity:

350

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

254.163g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

254.33g/mol

Monoisotopic Mass:

254.163g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

49.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.9