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2578-33-8 | H-D-Glu(OBzl)-OH
CAS No: 2578-33-8 Catalog No: AG003PAB MDL No:MFCD00063111
Product Description
Catalog Number:
AG003PAB
Chemical Name:
H-D-Glu(OBzl)-OH
CAS Number:
2578-33-8
Molecular Formula:
C12H15NO4
Molecular Weight:
237.2518
MDL Number:
MFCD00063111
IUPAC Name:
(2R)-2-amino-5-oxo-5-phenylmethoxypentanoic acid
InChI:
InChI=1S/C12H15NO4/c13-10(12(15)16)6-7-11(14)17-8-9-4-2-1-3-5-9/h1-5,10H,6-8,13H2,(H,15,16)/t10-/m1/s1
InChI Key:
BGGHCRNCRWQABU-SNVBAGLBSA-N
SMILES:
O=C(OCc1ccccc1)CC[C@H](C(=O)O)N
EC Number:
607-810-9
Properties
Complexity:
261
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
237.1g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
237.255g/mol
Monoisotopic Mass:
237.1g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
89.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.7
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