Home Sulfos D-Aspartic acid dibenzyl ester-p-toluenesulfonate

D-Aspartic acid dibenzyl ester-p-toluenesulfonate

CAS No.:
4079-64-5
Catalog Number:
AG00BXSQ
Molecular Formula:
C25H27NO7S
Molecular Weight:
485.5494
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$40
- +
5g
95%
In Stock USA
United States
$57
- +
25g
95%
In Stock USA
United States
$87
- +
100g
95%
In Stock USA
United States
$221
- +
Product Description
Catalog Number:
AG00BXSQ
Chemical Name:
D-Aspartic acid dibenzyl ester-p-toluenesulfonate
CAS Number:
4079-64-5
Molecular Formula:
C25H27NO7S
Molecular Weight:
485.5494
MDL Number:
MFCD00035102
IUPAC Name:
dibenzyl (2R)-2-aminobutanedioate;4-methylbenzenesulfonic acid
InChI:
InChI=1S/C18H19NO4.C7H8O3S/c19-16(18(21)23-13-15-9-5-2-6-10-15)11-17(20)22-12-14-7-3-1-4-8-14;1-6-2-4-7(5-3-6)11(8,9)10/h1-10,16H,11-13,19H2;2-5H,1H3,(H,8,9,10)/t16-;/m1./s1
InChI Key:
HLMUYZYLPUHSNV-PKLMIRHRSA-N
SMILES:
O=C(C[C@H](C(=O)OCc1ccccc1)N)OCc1ccccc1.Cc1ccc(cc1)S(=O)(=O)O
Properties
Complexity:
580  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
485.151g/mol
Formal Charge:
0
Heavy Atom Count:
34  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
485.551g/mol
Monoisotopic Mass:
485.151g/mol
Rotatable Bond Count:
10  
Topological Polar Surface Area:
141A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties