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Boc-β-tBu-D-Ala-OH

CAT: 0121-4028346.0001Size: 1 gDry Ice: NoHazardous: No
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CAT#:0121-4028346.0001Size:1 g
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CAS Number
112695-98-4
Specifications
A-4210.0001
Synonyms
Boc-D-Neopentylgly-OH Boc-γ-Me-D-Leu-OH Boc-D-Tba-OH
Sequence
Boc-β-tBu-D-Ala-OH
Molecular Formula
C₁₂H₂₃NO₄
Molecular Weight
245.32
Shipping Conditions
Ambient Temperature
Storage Temperature
Room temperature

Chemical Information

(R)-2-((tert-Butoxycarbonyl)amino)-4,4-dimethylpentanoic acid
CAS Number112695-98-4
PubChem CID7021114
IUPAC Name(2R)-4,4-dimethyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic acid
Molecular FormulaC12H23NO4
Molecular Weight245.32
XLogP2.6
Topological Polar Surface Area75.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Heavy Atom Count17
Formal Charge0
Complexity286
SMILES
CC(C)(C)C[C@H](C(=O)O)NC(=O)OC(C)(C)C
InChI
InChI=1S/C12H23NO4/c1-11(2,3)7-8(9(14)15)13-10(16)17-12(4,5)6/h8H,7H2,1-6H3,(H,13,16)(H,14,15)/t8-/m1/s1
InChIKey
PUQVQDMFCAGQQB-MRVPVSSYSA-N
Chemical Structure
2D Structure
2D structure of (R)-2-((tert-Butoxycarbonyl)amino)-4,4-dimethylpentanoic acid
CAS: 112695-98-4
CID: 7021114
Formula: C12H23NO4
MW: 245.32
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight245.32
XLogP32.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Exact Mass245.16270821
Monoisotopic Mass245.16270821
Topological Polar Surface Area75.6 Ų
Heavy Atom Count17
Formal Charge0
Complexity286
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

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Alternative Products

CatalogName
MBS405093-01Boc-D-Ala-OH
5-06078Boc-D-Ser(tBu)-OH
5-06182Boc-D-Tyr(tBu)-OH
5-06118Boc-D-Thr(tBu)-OH
OR1029758-01Boc-D-Ser (tBu) -OH
FB72175-01Boc-D-Tyr (tBu) -OH
5-06080Boc-D-Ser(tBu)-OH·DCHA
5-05987Boc-D-Phe-Ala-OH
HY-41121S6-01Boc-L-Ala-OH-d
BIPG2663-01Boc-D-isoGln-Ala-OH

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