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764-65-8

764-65-8 | ADIPATE

CAS No: 764-65-8 Catalog No: AG005BP9 MDL No:

Product Description

Catalog Number:
AG005BP9
Chemical Name:
ADIPATE
CAS Number:
764-65-8
Molecular Formula:
C6H8O4--
Molecular Weight:
144.1253
IUPAC Name:
hexanedioate
InChI:
InChI=1S/C6H10O4/c7-5(8)3-1-2-4-6(9)10/h1-4H2,(H,7,8)(H,9,10)/p-2
InChI Key:
WNLRTRBMVRJNCN-UHFFFAOYSA-L
SMILES:
[O-]C(=O)CCCCC(=O)[O-]
UNII:
U3YC62H084

Properties

Complexity:
103  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.042g/mol
Formal Charge:
-2  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
144.126g/mol
Monoisotopic Mass:
144.042g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
80.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  

Literature

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