Home Carboxys N-Boc-beta-alanine-beta-4'-methoxyphenyl-n-carboxyanhydride

N-Boc-beta-alanine-beta-4'-methoxyphenyl-n-carboxyanhydride

CAS No.:
886362-61-4
Catalog Number:
AG00GSM9
Molecular Formula:
C16H19NO6
Molecular Weight:
321.3252
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
1 week
United States
$300
- +
5g
96%
1 week
United States
$1023
- +
Product Description
Catalog Number:
AG00GSM9
Chemical Name:
N-Boc-beta-alanine-beta-4'-methoxyphenyl-n-carboxyanhydride
CAS Number:
886362-61-4
Molecular Formula:
C16H19NO6
Molecular Weight:
321.3252
MDL Number:
MFCD03839896
IUPAC Name:
tert-butyl 4-(4-methoxyphenyl)-2,6-dioxo-1,3-oxazinane-3-carboxylate
InChI:
InChI=1S/C16H19NO6/c1-16(2,3)23-15(20)17-12(9-13(18)22-14(17)19)10-5-7-11(21-4)8-6-10/h5-8,12H,9H2,1-4H3
InChI Key:
UNDXQUCUIVJJFK-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C1CC(=O)OC(=O)N1C(=O)OC(C)(C)C
Properties
Complexity:
476  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
321.121g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
321.329g/mol
Monoisotopic Mass:
321.121g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
82.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties