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Boc-d-mephe(4-cl)-oh

CAS No.:
125324-00-7
Catalog Number:
AG000NHA
Molecular Formula:
C15H20ClNO4
Molecular Weight:
313.7766
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$495
- +
1g
95%
In Stock USA
United States
$1485
- +
Product Description
Catalog Number:
AG000NHA
Chemical Name:
Boc-d-mephe(4-cl)-oh
CAS Number:
125324-00-7
Molecular Formula:
C15H20ClNO4
Molecular Weight:
313.7766
MDL Number:
MFCD00236864
IUPAC Name:
(2R)-3-(4-chlorophenyl)-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoic acid
InChI:
InChI=1S/C15H20ClNO4/c1-15(2,3)21-14(20)17(4)12(13(18)19)9-10-5-7-11(16)8-6-10/h5-8,12H,9H2,1-4H3,(H,18,19)/t12-/m1/s1
InChI Key:
GVKQCRRZMAVASQ-GFCCVEGCSA-N
SMILES:
CN([C@@H](C(=O)O)Cc1ccc(cc1)Cl)C(=O)OC(C)(C)C
Properties
Complexity:
372  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
313.108g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
313.778g/mol
Monoisotopic Mass:
313.108g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties