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819078-65-4 | (S)-4-Cbz-Morpholine-3-carboxylic acid
CAS No: 819078-65-4 Catalog No: AG0055WK MDL No:MFCD04114902
Product Description
Catalog Number:
AG0055WK
Chemical Name:
(S)-4-Cbz-Morpholine-3-carboxylic acid
CAS Number:
819078-65-4
Molecular Formula:
C13H15NO5
Molecular Weight:
265.2619
MDL Number:
MFCD04114902
IUPAC Name:
(3S)-4-phenylmethoxycarbonylmorpholine-3-carboxylic acid
InChI:
InChI=1S/C13H15NO5/c15-12(16)11-9-18-7-6-14(11)13(17)19-8-10-4-2-1-3-5-10/h1-5,11H,6-9H2,(H,15,16)/t11-/m0/s1
InChI Key:
SUWIPBQDWSTEDN-NSHDSACASA-N
SMILES:
OC(=O)[C@@H]1COCCN1C(=O)OCc1ccccc1
Properties
Complexity:
327
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
265.095g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
265.265g/mol
Monoisotopic Mass:
265.095g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
76.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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