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H-Glu-OBzl

CAT: 0121-4000337.0025Size: 25 gDry Ice: NoHazardous: No
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CAT#:0121-4000337.0025Size:25 g
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CAS Number
13030-09-6
Specifications
E-1865.0025
Sequence
H-Glu-OBzl
Molecular Formula
C₁₂H₁₅NO₄
Molecular Weight
237.26
Shipping Conditions
Ambient Temperature
Storage Temperature
+5 ± 3 °C

Chemical Information

(4S)-4-amino-5-benzyloxy-5-oxo-pentanoic acid
CAS Number13030-09-6
PubChem CID7009632
IUPAC Name(4S)-4-amino-5-oxo-5-phenylmethoxypentanoic acid
Molecular FormulaC12H15NO4
Molecular Weight237.25
XLogP-1.7
Topological Polar Surface Area89.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Heavy Atom Count17
Formal Charge0
Complexity261
SMILES
C1=CC=C(C=C1)COC(=O)[C@H](CCC(=O)O)N
InChI
InChI=1S/C12H15NO4/c13-10(6-7-11(14)15)12(16)17-8-9-4-2-1-3-5-9/h1-5,10H,6-8,13H2,(H,14,15)/t10-/m0/s1
InChIKey
HFZKKJHBHCZXTQ-JTQLQIEISA-N
Chemical Structure
2D Structure
2D structure of (4S)-4-amino-5-benzyloxy-5-oxo-pentanoic acid
CAS: 13030-09-6
CID: 7009632
Formula: C12H15NO4
MW: 237.25
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight237.25
XLogP3-1.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Exact Mass237.10010796
Monoisotopic Mass237.10010796
Topological Polar Surface Area89.6 Ų
Heavy Atom Count17
Formal Charge0
Complexity261
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes