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Boc-d-dab(dde)-oh

CAS No.:
1263046-41-8
Catalog Number:
AG000SI0
Molecular Formula:
C19H30N2O6
Molecular Weight:
382.4513
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
≥ 99% (HPLC)
1 week
United States
$96
- +
1g
≥ 99% (HPLC)
1 week
United States
$155
- +
Product Description
Catalog Number:
AG000SI0
Chemical Name:
Boc-d-dab(dde)-oh
CAS Number:
1263046-41-8
Molecular Formula:
C19H30N2O6
Molecular Weight:
382.4513
MDL Number:
MFCD05663722
IUPAC Name:
(2R)-4-[1-(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)ethylideneamino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid
InChI:
InChI=1S/C19H30N2O6/c1-11(15-13(22)9-19(5,6)10-14(15)23)20-8-7-12(16(24)25)21-17(26)27-18(2,3)4/h12,22H,7-10H2,1-6H3,(H,21,26)(H,24,25)/t12-/m1/s1
InChI Key:
NKFOGFBBBAQNFL-GFCCVEGCSA-N
SMILES:
O=C(OC(C)(C)C)N[C@@H](C(=O)O)CCNC(=C1C(=O)CC(CC1=O)(C)C)C
Properties
Complexity:
670  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
382.21g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
382.457g/mol
Monoisotopic Mass:
382.21g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
125A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties