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1260640-64-9

1260640-64-9 | Norvaline, N-[(1,1-dimethylethoxy)carbonyl]-5,5-difluoro-, methyl ester

CAS No: 1260640-64-9 Catalog No: AG000QXP MDL No:MFCD11975810

Product Description

Catalog Number:
AG000QXP
Chemical Name:
Norvaline, N-[(1,1-dimethylethoxy)carbonyl]-5,5-difluoro-, methyl ester
CAS Number:
1260640-64-9
Molecular Formula:
C11H19F2NO4
Molecular Weight:
267.2697
MDL Number:
MFCD11975810
IUPAC Name:
methyl 5,5-difluoro-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate
InChI:
InChI=1S/C11H19F2NO4/c1-11(2,3)18-10(16)14-7(9(15)17-4)5-6-8(12)13/h7-8H,5-6H2,1-4H3,(H,14,16)
InChI Key:
MVVRNSOKIBQXBA-UHFFFAOYSA-N
SMILES:
COC(=O)[C@@H](NC(=O)OC(C)(C)C)CCC(F)F

Properties

Complexity:
289  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.128g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
267.273g/mol
Monoisotopic Mass:
267.128g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  

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