Name: Name:(R)-3-((tert-Butoxycarbonyl)amino)-3-(4-(trifluoromethyl)phenyl)propanoic acid
Brand: Angene
SKU: AG003CAU
Rating: 90 (10 reviews)

(R)-3-((tert-Butoxycarbonyl)amino)-3-(4-(trifluoromethyl)phenyl)propanoic acid

CAS No.:

501015-19-6

Catalog Number:

AG003CAU

Molecular Formula:

C15H18F3NO4

Molecular Weight:

333.3029

Catalog Number:

AG003CAU

Chemical Name:

(R)-3-((tert-Butoxycarbonyl)amino)-3-(4-(trifluoromethyl)phenyl)propanoic acid

CAS Number:

501015-19-6

Molecular Formula:

C15H18F3NO4

Molecular Weight:

333.3029

MDL Number:

MFCD03427965

IUPAC Name:

(3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-(trifluoromethyl)phenyl]propanoic acid

InChI:

InChI=1S/C15H18F3NO4/c1-14(2,3)23-13(22)19-11(8-12(20)21)9-4-6-10(7-5-9)15(16,17)18/h4-7,11H,8H2,1-3H3,(H,19,22)(H,20,21)/t11-/m1/s1

InChI Key:

WJMVMQYNFZQHGW-LLVKDONJSA-N

SMILES:

OC(=O)C[C@H](c1ccc(cc1)C(F)(F)F)NC(=O)OC(C)(C)C

Complexity:

423

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

333.119g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

333.307g/mol

Monoisotopic Mass:

333.119g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

75.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.8