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1333319-68-8 | 1,2-Pyrrolidinedicarboxylic acid, 2-(2-propen-1-yl)-, 1-(1,1-dimethylethyl) 2-ethyl ester
CAS No: 1333319-68-8 Catalog No: AG0014O7 MDL No:MFCD18909479
Product Description
Catalog Number:
AG0014O7
Chemical Name:
1,2-Pyrrolidinedicarboxylic acid, 2-(2-propen-1-yl)-, 1-(1,1-dimethylethyl) 2-ethyl ester
CAS Number:
1333319-68-8
Molecular Formula:
C15H25NO4
Molecular Weight:
283.3633
MDL Number:
MFCD18909479
IUPAC Name:
1-O-tert-butyl 2-O-ethyl 2-prop-2-enylpyrrolidine-1,2-dicarboxylate
InChI:
InChI=1S/C15H25NO4/c1-6-9-15(12(17)19-7-2)10-8-11-16(15)13(18)20-14(3,4)5/h6H,1,7-11H2,2-5H3
InChI Key:
RGLGSNCDWXORJR-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1(CCCN1C(=O)OC(C)(C)C)CC=C
Properties
Complexity:
386
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.178g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
283.368g/mol
Monoisotopic Mass:
283.178g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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