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Boc-Arg (Boc) 2-OH

CAT: 0804-HY-W088151-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-W088151-01Size:25 mg
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Description
Boc-Arg (Boc) 2-OH is an amino acid building block and derivative of arginine.
CAS Number
97745-69-2
UNSPSC
12352211
Hazard Statement
H302, H315, H319, H335
Target
Amino Acid Derivatives
Type
Reference compound
Related Pathways
Others
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/boc-arg-boc-2-oh.html
Purity
99.13
Solubility
DMSO : 100 mg/mL (ultrasonic)
Smiles
CC(C)(C)OC(N[C@H](C(O)=O)CCCN(C(OC(C)(C)C)=O)C(NC(OC(C)(C)C)=O)=N)=O
Molecular Formula
C21H38N4O8
Molecular Weight
474.55
Precautions
H302, H315, H319, H335
Shipping Conditions
Room Temperature
Storage Conditions
-20°C, 3 years; 4°C, 2 years (Powder)
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

Boc-arg(boc)2-OH
CAS Number97745-69-2
PubChem CID11385959
IUPAC Name(2S)-5-[bis[(2-methylpropan-2-yl)oxycarbonylamino]methylideneamino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic acid
Molecular FormulaC21H38N4O8
Molecular Weight474.5
XLogP4
Topological Polar Surface Area165
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count9
Rotatable Bond Count14
Heavy Atom Count33
Formal Charge0
Complexity698
SMILES
CC(C)(C)OC(=O)N[C@@H](CCCN=C(NC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C)C(=O)O
InChI
InChI=1S/C21H38N4O8/c1-19(2,3)31-16(28)23-13(14(26)27)11-10-12-22-15(24-17(29)32-20(4,5)6)25-18(30)33-21(7,8)9/h13H,10-12H2,1-9H3,(H,23,28)(H,26,27)(H2,22,24,25,29,30)/t13-/m0/s1
InChIKey
BGOFOVHACSQSIE-ZDUSSCGKSA-N
Chemical Structure
2D Structure
2D structure of Boc-arg(boc)2-OH
CAS: 97745-69-2
CID: 11385959
Formula: C21H38N4O8
MW: 474.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight474.5
XLogP34
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count9
Rotatable Bond Count14
Exact Mass474.26896418
Monoisotopic Mass474.26896418
Topological Polar Surface Area165 Ų
Heavy Atom Count33
Formal Charge0
Complexity698
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