Name: Name:3-(3-(((tert-Butoxycarbonyl)amino)methyl)phenyl)propanoic acid
Brand: Angene
SKU: AG007DSG
Rating: 90 (10 reviews)

3-(3-(((tert-Butoxycarbonyl)amino)methyl)phenyl)propanoic acid

CAS No.:

171663-00-6

Catalog Number:

AG007DSG

Molecular Formula:

C15H21NO4

Molecular Weight:

279.3315

Catalog Number:

AG007DSG

Chemical Name:

3-(3-(((tert-Butoxycarbonyl)amino)methyl)phenyl)propanoic acid

CAS Number:

171663-00-6

Molecular Formula:

C15H21NO4

Molecular Weight:

279.3315

MDL Number:

MFCD08234834

IUPAC Name:

3-[3-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]phenyl]propanoic acid

InChI:

InChI=1S/C15H21NO4/c1-15(2,3)20-14(19)16-10-12-6-4-5-11(9-12)7-8-13(17)18/h4-6,9H,7-8,10H2,1-3H3,(H,16,19)(H,17,18)

InChI Key:

XTKXCPYRQMMIHI-UHFFFAOYSA-N

SMILES:

OC(=O)CCc1cccc(c1)CNC(=O)OC(C)(C)C

Complexity:

335

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

279.147g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

279.336g/mol

Monoisotopic Mass:

279.147g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

75.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.2