Home Other Building Blocks 4-AMINOBUTYRIC-2,2-D2 ACID

4-AMINOBUTYRIC-2,2-D2 ACID

CAS No.:
67910-98-9
Catalog Number:
AG00FBOX
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00FBOX
Chemical Name:
4-AMINOBUTYRIC-2,2-D2 ACID
CAS Number:
67910-98-9
MDL Number:
MFCD00084111
IUPAC Name:
4-amino-2,2-dideuteriobutanoic acid
InChI:
InChI=1S/C4H9NO2/c5-3-1-2-4(6)7/h1-3,5H2,(H,6,7)/i2D2
InChI Key:
BTCSSZJGUNDROE-CBTSVUPCSA-N
Properties
Complexity:
62.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
105.076g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
2  
Molecular Weight:
105.133g/mol
Monoisotopic Mass:
105.076g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-3.2  
Literature
Title Journal
Gabapentin in horses: validation of an analytical method for gabapentin quantitation. Journal of analytical toxicology 20070101
Properties