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Z-Glycine

CAT: 0127-BUP19004Size: 1 mLDry Ice: NoHazardous: No
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CAT#:0127-BUP19004Size:1 mL
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CAS Number
1138-80-3
Synonyms
Carbobenzoxyglycine, N-Carbobenzoxyglycine
Purity
=98%
Smiles
OC(=O)CNC(=O)OCC1=CC=CC=C1

Chemical Information

Benzyloxycarbonylglycine

N-benzyloxycarbonylglycine is a derivative of glycine having a benzyloxycarbonyl protecting group attached to the nitrogen. It is a conjugate acid of a N-benzyloxycarbonylglycinate.

CAS Number1138-80-3
PubChem CID14349
IUPAC Name2-(phenylmethoxycarbonylamino)acetic acid
Molecular FormulaC10H11NO4
Molecular Weight209.20
XLogP1
Topological Polar Surface Area75.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count15
Formal Charge0
Complexity223
SMILES
C1=CC=C(C=C1)COC(=O)NCC(=O)O
InChI
InChI=1S/C10H11NO4/c12-9(13)6-11-10(14)15-7-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,14)(H,12,13)
InChIKey
CJUMAFVKTCBCJK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Benzyloxycarbonylglycine
CAS: 1138-80-3
CID: 14349
Formula: C10H11NO4
MW: 209.20
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight209.20
XLogP31
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass209.06880783
Monoisotopic Mass209.06880783
Topological Polar Surface Area75.6 Ų
Heavy Atom Count15
Formal Charge0
Complexity223
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes