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175526-97-3 | 3-Pyrrolidineacetic acid, 1-[(1,1-dimethylethoxy)carbonyl]-
CAS No: 175526-97-3 Catalog No: AG002109 MDL No:MFCD02179024
Product Description
Catalog Number:
AG002109
Chemical Name:
3-Pyrrolidineacetic acid, 1-[(1,1-dimethylethoxy)carbonyl]-
CAS Number:
175526-97-3
Molecular Formula:
C11H19NO4
Molecular Weight:
229.2729
MDL Number:
MFCD02179024
IUPAC Name:
2-[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-3-yl]acetic acid
InChI:
InChI=1S/C11H19NO4/c1-11(2,3)16-10(15)12-5-4-8(7-12)6-9(13)14/h8H,4-7H2,1-3H3,(H,13,14)
InChI Key:
SKEXQIJIXQSFRX-UHFFFAOYSA-N
SMILES:
OC(=O)CC1CCN(C1)C(=O)OC(C)(C)C
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.131g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
229.276g/mol
Monoisotopic Mass:
229.131g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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