Home Other Building Blocks Acetylsalicylic Acid-d3

Acetylsalicylic Acid-d3

CAS No.:
921943-73-9
Catalog Number:
AG00GXK5
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00GXK5
Chemical Name:
Acetylsalicylic Acid-d3
CAS Number:
921943-73-9
MDL Number:
MFCD09752106
IUPAC Name:
2-(2,2,2-trideuterioacetyl)oxybenzoic acid
InChI:
InChI=1S/C9H8O4/c1-6(10)13-8-5-3-2-4-7(8)9(11)12/h2-5H,1H3,(H,11,12)/i1D3
InChI Key:
BSYNRYMUTXBXSQ-FIBGUPNXSA-N
UNII:
7F6Y89636M
Properties
Complexity:
212  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.061g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
3  
Molecular Weight:
183.177g/mol
Monoisotopic Mass:
183.061g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties