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647857-74-7 | (R)-1-tert-Butyl 2-methyl 4,4-difluoropyrrolidine-1,2-dicarboxylate
CAS No: 647857-74-7 Catalog No: AG003A92 MDL No:MFCD11976647
Product Description
Catalog Number:
AG003A92
Chemical Name:
(R)-1-tert-Butyl 2-methyl 4,4-difluoropyrrolidine-1,2-dicarboxylate
CAS Number:
647857-74-7
Molecular Formula:
C11H17F2NO4
Molecular Weight:
265.2538
MDL Number:
MFCD11976647
IUPAC Name:
1-O-tert-butyl 2-O-methyl (2R)-4,4-difluoropyrrolidine-1,2-dicarboxylate
InChI:
InChI=1S/C11H17F2NO4/c1-10(2,3)18-9(16)14-6-11(12,13)5-7(14)8(15)17-4/h7H,5-6H2,1-4H3/t7-/m1/s1
InChI Key:
RQDZKOOUQIDZOG-SSDOTTSWSA-N
SMILES:
COC(=O)[C@H]1CC(CN1C(=O)OC(C)(C)C)(F)F
Properties
Complexity:
351
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
265.113g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
265.257g/mol
Monoisotopic Mass:
265.113g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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