Home Other Building Blocks 2-Isopropylmalic acid

2-Isopropylmalic acid

CAS No.:
3237-44-3
Catalog Number:
AG003HHU
Molecular Formula:
Molecular Weight:
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Purity
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Product Description
Catalog Number:
AG003HHU
Chemical Name:
2-Isopropylmalic acid
CAS Number:
3237-44-3
MDL Number:
MFCD00075003
IUPAC Name:
2-hydroxy-2-propan-2-ylbutanedioic acid
InChI:
InChI=1S/C7H12O5/c1-4(2)7(12,6(10)11)3-5(8)9/h4,12H,3H2,1-2H3,(H,8,9)(H,10,11)
InChI Key:
BITYXLXUCSKTJS-UHFFFAOYSA-N
Properties
Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.068g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
176.168g/mol
Monoisotopic Mass:
176.068g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
94.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2  
Literature
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Properties