Home Carbonyls L-Proline, N-[(1,1-dimethylethoxy)carbonyl]-3-methyl-L-valyl-4-hydroxy-,(4R)-

L-Proline, N-[(1,1-dimethylethoxy)carbonyl]-3-methyl-L-valyl-4-hydroxy-,(4R)-

CAS No.:
630421-46-4
Catalog Number:
AG00ILZ3
Molecular Formula:
C16H28N2O6
Molecular Weight:
344.4033
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Product Description
Catalog Number:
AG00ILZ3
Chemical Name:
L-Proline, N-[(1,1-dimethylethoxy)carbonyl]-3-methyl-L-valyl-4-hydroxy-,(4R)-
CAS Number:
630421-46-4
Molecular Formula:
C16H28N2O6
Molecular Weight:
344.4033
MDL Number:
MFCD30729679
IUPAC Name:
1-[3,3-dimethyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]-4-hydroxypyrrolidine-2-carboxylic acid
InChI:
InChI=1S/C16H28N2O6/c1-15(2,3)11(17-14(23)24-16(4,5)6)12(20)18-8-9(19)7-10(18)13(21)22/h9-11,19H,7-8H2,1-6H3,(H,17,23)(H,21,22)
InChI Key:
XYXBVELFAOEJDK-UHFFFAOYSA-N
SMILES:
O[C@H]1CN([C@@H](C1)C(=O)O)C(=O)[C@H](C(C)(C)C)NC(=O)OC(C)(C)C
Properties
Complexity:
506  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
344.195g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
344.408g/mol
Monoisotopic Mass:
344.195g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
116A^2
Undefined Atom Stereocenter Count:
3  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties