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Boc-α-allyl-DL-Pro-OH

CAS No.:
315234-49-2
Catalog Number:
AG003OIR
Molecular Formula:
C13H21NO4
Molecular Weight:
255.3101
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Product Description
Catalog Number:
AG003OIR
Chemical Name:
Boc-α-allyl-DL-Pro-OH
CAS Number:
315234-49-2
Molecular Formula:
C13H21NO4
Molecular Weight:
255.3101
MDL Number:
MFCD03095490
IUPAC Name:
1-[(2-methylpropan-2-yl)oxycarbonyl]-2-prop-2-enylpyrrolidine-2-carboxylic acid
InChI:
InChI=1S/C13H21NO4/c1-5-7-13(10(15)16)8-6-9-14(13)11(17)18-12(2,3)4/h5H,1,6-9H2,2-4H3,(H,15,16)
InChI Key:
ZTMLHNDSVVOEEH-UHFFFAOYSA-N
SMILES:
C=CCC1(CCCN1C(=O)OC(C)(C)C)C(=O)O
Properties
Complexity:
359  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.147g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
255.314g/mol
Monoisotopic Mass:
255.147g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties