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1260637-15-7 | Cyclopentanecarboxylic acid, 1-[[(1,1-dimethylethoxy)carbonyl]amino]-3-methoxy-
CAS No: 1260637-15-7 Catalog No: AG000QWR MDL No:
Product Description
Catalog Number:
AG000QWR
Chemical Name:
Cyclopentanecarboxylic acid, 1-[[(1,1-dimethylethoxy)carbonyl]amino]-3-methoxy-
CAS Number:
1260637-15-7
Molecular Formula:
C12H21NO5
Molecular Weight:
259.2988
IUPAC Name:
3-methoxy-1-[(2-methylpropan-2-yl)oxycarbonylamino]cyclopentane-1-carboxylic acid
InChI:
InChI=1S/C12H21NO5/c1-11(2,3)18-10(16)13-12(9(14)15)6-5-8(7-12)17-4/h8H,5-7H2,1-4H3,(H,13,16)(H,14,15)
InChI Key:
QTVILWKSHUHYPB-UHFFFAOYSA-N
SMILES:
COC1CCC(C1)(NC(=O)OC(C)(C)C)C(=O)O
Properties
Complexity:
336
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.142g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
259.302g/mol
Monoisotopic Mass:
259.142g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
84.9A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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