Home Other Building Blocks 4-PHENYLBUTYRIC-D11 ACID

4-PHENYLBUTYRIC-D11 ACID

CAS No.:
358730-86-6
Catalog Number:
AG00C5FY
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00C5FY
Chemical Name:
4-PHENYLBUTYRIC-D11 ACID
CAS Number:
358730-86-6
MDL Number:
MFCD01861603
IUPAC Name:
2,2,3,3,4,4-hexadeuterio-4-(2,3,4,5,6-pentadeuteriophenyl)butanoic acid
InChI:
InChI=1S/C10H12O2/c11-10(12)8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,11,12)/i1D,2D,3D,4D2,5D,6D,7D2,8D2
InChI Key:
OBKXEAXTFZPCHS-VRWITDQQSA-N
Properties
Complexity:
137  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.153g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
11  
Molecular Weight:
175.271g/mol
Monoisotopic Mass:
175.153g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties