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114214-71-0 | 1-Pyrrolidinecarboxylic acid, 3-methylene-, 1,1-dimethylethyl ester
CAS No: 114214-71-0 Catalog No: AG000ASX MDL No:MFCD12407903
Product Description
Catalog Number:
AG000ASX
Chemical Name:
1-Pyrrolidinecarboxylic acid, 3-methylene-, 1,1-dimethylethyl ester
CAS Number:
114214-71-0
Molecular Formula:
C10H17NO2
Molecular Weight:
183.2475
MDL Number:
MFCD12407903
IUPAC Name:
tert-butyl 3-methylidenepyrrolidine-1-carboxylate
InChI:
InChI=1S/C10H17NO2/c1-8-5-6-11(7-8)9(12)13-10(2,3)4/h1,5-7H2,2-4H3
InChI Key:
PXTONRTYYUAUJU-UHFFFAOYSA-N
SMILES:
C=C1CCN(C1)C(=O)OC(C)(C)C
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.126g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
183.251g/mol
Monoisotopic Mass:
183.126g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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