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Home Carboxys Cis-1,2-cyclohexanedicarboxylic acid

Cis-1,2-cyclohexanedicarboxylic acid

CAS No.:
610-09-3
Catalog Number:
AG00IASA
Molecular Formula:
C8H12O4
Molecular Weight:
172.1785
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$13
- +
25g
98%
In Stock USA
United States
$19
- +
100g
98%
In Stock USA
United States
$50
- +
500g
98%
In Stock USA
United States
$138
- +
Product Description
Catalog Number:
AG00IASA
Chemical Name:
Cis-1,2-cyclohexanedicarboxylic acid
CAS Number:
610-09-3
Molecular Formula:
C8H12O4
Molecular Weight:
172.1785
MDL Number:
MFCD00064949
IUPAC Name:
(1R,2S)-cyclohexane-1,2-dicarboxylic acid
InChI:
InChI=1S/C8H12O4/c9-7(10)5-3-1-2-4-6(5)8(11)12/h5-6H,1-4H2,(H,9,10)(H,11,12)/t5-,6+
InChI Key:
QSAWQNUELGIYBC-OLQVQODUSA-N
SMILES:
OC(=O)[C@@H]1CCCC[C@@H]1C(=O)O
EC Number:
445-870-6
NSC Number:
57637
Properties
Complexity:
177  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
172.074g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
172.18g/mol
Monoisotopic Mass:
172.074g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Literature
Title Journal
catena-Poly[[dimethyl-tin(IV)]-μ-cis-cyclo-hexane-1,2-dicarboxyl-ato]. Acta crystallographica. Section E, Structure reports online 20090301
Properties