Home Sulfos L-Alanine benzyl ester 4-toluenesulfonate

L-Alanine benzyl ester 4-toluenesulfonate

CAS No.:
42854-62-6
Catalog Number:
AG00I89M
Molecular Formula:
C17H21NO5S
Molecular Weight:
351.4173
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$13
- +
5g
97%
In Stock USA
United States
$19
- +
25g
97%
In Stock USA
United States
$50
- +
100g
97%
In Stock USA
United States
$138
- +
Product Description
Catalog Number:
AG00I89M
Chemical Name:
L-Alanine benzyl ester 4-toluenesulfonate
CAS Number:
42854-62-6
Molecular Formula:
C17H21NO5S
Molecular Weight:
351.4173
MDL Number:
MFCD00066143
IUPAC Name:
benzyl (2S)-2-aminopropanoate;4-methylbenzenesulfonic acid
InChI:
InChI=1S/C10H13NO2.C7H8O3S/c1-8(11)10(12)13-7-9-5-3-2-4-6-9;1-6-2-4-7(5-3-6)11(8,9)10/h2-6,8H,7,11H2,1H3;2-5H,1H3,(H,8,9,10)/t8-;/m0./s1
InChI Key:
NWOPHJSSBMABBD-QRPNPIFTSA-N
SMILES:
O=C(C(N)C)OCc1ccccc1.Cc1ccc(cc1)S(=O)(=O)O
EC Number:
255-969-4
Properties
Complexity:
371  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
351.114g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
351.417g/mol
Monoisotopic Mass:
351.114g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
115A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties