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Boc-n-me-d-allo-ile-oh

CAS No.:
53462-50-3
Catalog Number:
AG00D8FS
Molecular Formula:
C12H23NO4
Molecular Weight:
245.3153
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
≥ 95% (NMR)
1 week
United States
$170
- +
250mg
≥ 95% (NMR)
1 week
United States
$287
- +
1g
≥ 95% (NMR)
1 week
United States
$469
- +
5g
≥ 95% (NMR)
1 week
United States
$1909
- +
Product Description
Catalog Number:
AG00D8FS
Chemical Name:
Boc-n-me-d-allo-ile-oh
CAS Number:
53462-50-3
Molecular Formula:
C12H23NO4
Molecular Weight:
245.3153
MDL Number:
MFCD00237568
IUPAC Name:
(2R,3S)-3-methyl-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pentanoic acid
InChI:
InChI=1S/C12H23NO4/c1-7-8(2)9(10(14)15)13(6)11(16)17-12(3,4)5/h8-9H,7H2,1-6H3,(H,14,15)/t8-,9+/m0/s1
InChI Key:
HTBIAUMDQYXOFG-DTWKUNHWSA-N
SMILES:
CC[C@@H]([C@@H](N(C(=O)OC(C)(C)C)C)C(=O)O)C
Properties
Complexity:
283  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
245.163g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
245.319g/mol
Monoisotopic Mass:
245.163g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties