Home Other Building Blocks 2-OXOADIPIC ACID, 98

2-OXOADIPIC ACID, 98

CAS No.:
3184-35-8
Catalog Number:
AG00CKTY
Molecular Formula:
C6H8O5
Molecular Weight:
160.1247
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Product Description
Catalog Number:
AG00CKTY
Chemical Name:
2-OXOADIPIC ACID, 98
CAS Number:
3184-35-8
Molecular Formula:
C6H8O5
Molecular Weight:
160.1247
MDL Number:
MFCD00010004
IUPAC Name:
2-oxohexanedioic acid
InChI:
InChI=1S/C6H8O5/c7-4(6(10)11)2-1-3-5(8)9/h1-3H2,(H,8,9)(H,10,11)
InChI Key:
FGSBNBBHOZHUBO-UHFFFAOYSA-N
SMILES:
OC(=O)CCCC(=O)C(=O)O
UNII:
BB72FKL1M2
Properties
Complexity:
183  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.037g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
160.125g/mol
Monoisotopic Mass:
160.037g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
91.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5  
Literature
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