Home Other Building Blocks 2-hydroxy-2-methylbutane-1,4-dioic acid

2-hydroxy-2-methylbutane-1,4-dioic acid

CAS No.:
597-44-4
Catalog Number:
AG01EA6L
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01EA6L
Chemical Name:
2-hydroxy-2-methylbutane-1,4-dioic acid
CAS Number:
597-44-4
IUPAC Name:
2-hydroxy-2-methylbutanedioic acid
InChI:
InChI=1S/C5H8O5/c1-5(10,4(8)9)2-3(6)7/h10H,2H2,1H3,(H,6,7)(H,8,9)
InChI Key:
XFTRTWQBIOMVPK-UHFFFAOYSA-N
EC Number:
209-901-5
NSC Number:
80648
Properties
Complexity:
163  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.037g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
148.114g/mol
Monoisotopic Mass:
148.037g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
94.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9  
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