Home Sulfos N-Boc-4-(methylsulfonyl)benzylamine

N-Boc-4-(methylsulfonyl)benzylamine

CAS No.:
694480-96-1
Catalog Number:
AG003STA
Molecular Formula:
C13H19NO4S
Molecular Weight:
285.3593
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
>97%
In Stock USA
United States
$90
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Product Description
Catalog Number:
AG003STA
Chemical Name:
N-Boc-4-(methylsulfonyl)benzylamine
CAS Number:
694480-96-1
Molecular Formula:
C13H19NO4S
Molecular Weight:
285.3593
MDL Number:
MFCD21106154
IUPAC Name:
tert-butyl N-[(4-methylsulfonylphenyl)methyl]carbamate
InChI:
InChI=1S/C13H19NO4S/c1-13(2,3)18-12(15)14-9-10-5-7-11(8-6-10)19(4,16)17/h5-8H,9H2,1-4H3,(H,14,15)
InChI Key:
GJMNGNDEJDAWCG-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NCc1ccc(cc1)S(=O)(=O)C
Properties
Complexity:
397  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.103g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
285.358g/mol
Monoisotopic Mass:
285.103g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
80.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties