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28697-11-2 | (S)-1-N-Cbz-Pipecolinic acid
CAS No: 28697-11-2 Catalog No: AG003CEL MDL No:MFCD01863645
Product Description
Catalog Number:
AG003CEL
Chemical Name:
(S)-1-N-Cbz-Pipecolinic acid
CAS Number:
28697-11-2
Molecular Formula:
C14H17NO4
Molecular Weight:
263.2891
MDL Number:
MFCD01863645
IUPAC Name:
(2S)-1-phenylmethoxycarbonylpiperidine-2-carboxylic acid
InChI:
InChI=1S/C14H17NO4/c16-13(17)12-8-4-5-9-15(12)14(18)19-10-11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10H2,(H,16,17)/t12-/m0/s1
InChI Key:
ZSAIHAKADPJIGN-LBPRGKRZSA-N
SMILES:
OC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1
Properties
Complexity:
325
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
263.116g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
263.293g/mol
Monoisotopic Mass:
263.116g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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