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Ac-tyr(me)-ome

CAS No.:
17355-24-7
Catalog Number:
AG001Z0Z
Molecular Formula:
C13H17NO4
Molecular Weight:
251.2784
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$94
- +
1g
95%
In Stock USA
United States
$188
- +
5g
95%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG001Z0Z
Chemical Name:
Ac-tyr(me)-ome
CAS Number:
17355-24-7
Molecular Formula:
C13H17NO4
Molecular Weight:
251.2784
MDL Number:
MFCD00069961
IUPAC Name:
methyl (2S)-2-acetamido-3-(4-methoxyphenyl)propanoate
InChI:
InChI=1S/C13H17NO4/c1-9(15)14-12(13(16)18-3)8-10-4-6-11(17-2)7-5-10/h4-7,12H,8H2,1-3H3,(H,14,15)/t12-/m0/s1
InChI Key:
HCLXPKBWRUCQAF-LBPRGKRZSA-N
SMILES:
COC(=O)[C@H](Cc1ccc(cc1)OC)NC(=O)C
Properties
Complexity:
285  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
251.116g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
251.282g/mol
Monoisotopic Mass:
251.116g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties