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1260654-77-0 | Cyclopentanecarboxylic acid, 2-[[(phenylmethoxy)carbonyl]amino]-, methyl ester
CAS No: 1260654-77-0 Catalog No: AG000QZC MDL No:
Product Description
Catalog Number:
AG000QZC
Chemical Name:
Cyclopentanecarboxylic acid, 2-[[(phenylmethoxy)carbonyl]amino]-, methyl ester
CAS Number:
1260654-77-0
Molecular Formula:
C15H19NO4
Molecular Weight:
277.3157
IUPAC Name:
methyl 2-(phenylmethoxycarbonylamino)cyclopentane-1-carboxylate
InChI:
InChI=1S/C15H19NO4/c1-19-14(17)12-8-5-9-13(12)16-15(18)20-10-11-6-3-2-4-7-11/h2-4,6-7,12-13H,5,8-10H2,1H3,(H,16,18)
InChI Key:
STKURCYYQJHHJC-UHFFFAOYSA-N
SMILES:
COC(=O)C1CCCC1NC(=O)OCc1ccccc1
Properties
Complexity:
339
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.131g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
277.32g/mol
Monoisotopic Mass:
277.131g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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