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Boc-Glu(OcHex)-OH.DCHA

CAT: 0607-A6635-100000Size: 100 gDry Ice: NoHazardous: No
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CAT#:0607-A6635-100000Size:100 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
73821-98-4
Product Name Alternative
dicyclohexylamine (S,E)-2-((tert-butoxyoxidomethylene)amino)-5-(cyclohexyloxy)-5-oxopentanoate
Purity
0.98
Smiles
CC(C)(O/C(O)=N/[C@@](C(O)=O)([H])CCC(OC1CCCCC1)=O)C.C2(NC3CCCCC3)CCCCC2
Molecular Formula
C28H50N2O6
Molecular Weight
510.71
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

Boc-Glu(OcHex)-OH.DCHA
CAS Number73821-98-4
PubChem CID91825817
IUPAC NameN-cyclohexylcyclohexanamine;(2S)-5-cyclohexyloxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxopentanoic acid
Molecular FormulaC28H50N2O6
Molecular Weight510.7
Topological Polar Surface Area114
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count11
Heavy Atom Count36
Formal Charge0
Complexity539
SMILES
CC(C)(C)OC(=O)N[C@@H](CCC(=O)OC1CCCCC1)C(=O)O.C1CCC(CC1)NC2CCCCC2
InChI
InChI=1S/C16H27NO6.C12H23N/c1-16(2,3)23-15(21)17-12(14(19)20)9-10-13(18)22-11-7-5-4-6-8-11;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h11-12H,4-10H2,1-3H3,(H,17,21)(H,19,20);11-13H,1-10H2/t12-;/m0./s1
InChIKey
QXKNHFZXSYWRFG-YDALLXLXSA-N
Chemical Structure
2D Structure
2D structure of Boc-Glu(OcHex)-OH.DCHA
CAS: 73821-98-4
CID: 91825817
Formula: C28H50N2O6
MW: 510.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight510.7
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count11
Exact Mass510.36688732
Monoisotopic Mass510.36688732
Topological Polar Surface Area114 Ų
Heavy Atom Count36
Formal Charge0
Complexity539
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
5-05772Boc-D-Glu(OcHex)-OH·DCHA
4030405.0100Boc-Glu (OcHex) -OH
A-2770.0025Boc-Glu(OcHex)-OH
468999-01Z-L-Glu (ochex) -oh dcha
A-3425.0025Boc-D-Glu(OcHex)-OH
4018226.0005Boc-D-Glu (OcHex) -OH
2134-01Boc-Glu (OcHex)
A-1695.0025Boc-Glu(OMe)-OH · DCHA
A-4085.0025Boc-Glu-OcHex
5-06512Fmoc-Glu(OcHex)-OH

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