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Home Carboxys 4-Hydroxycyclohexane-1-carboxylic acid

4-Hydroxycyclohexane-1-carboxylic acid

CAS No.:
17419-81-7
Catalog Number:
AG003LJE
Molecular Formula:
C7H12O3
Molecular Weight:
144.1684
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$16
- +
5g
95%
In Stock USA
United States
$47
- +
25g
95%
In Stock USA
United States
$125
- +
100g
95%
In Stock USA
United States
$400
- +
Product Description
Catalog Number:
AG003LJE
Chemical Name:
4-Hydroxycyclohexane-1-carboxylic acid
CAS Number:
17419-81-7
Molecular Formula:
C7H12O3
Molecular Weight:
144.1684
MDL Number:
MFCD00066271
IUPAC Name:
4-hydroxycyclohexane-1-carboxylic acid
InChI:
InChI=1S/C7H12O3/c8-6-3-1-5(2-4-6)7(9)10/h5-6,8H,1-4H2,(H,9,10)
InChI Key:
HCFRWBBJISAZNK-UHFFFAOYSA-N
SMILES:
OC1CCC(CC1)C(=O)O
Properties
Complexity:
125  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.079g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
144.17g/mol
Monoisotopic Mass:
144.079g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Literature
Title Journal
A novel synthetic approach to very late antigen-4 antagonist trans-4-[1-[[2,5-dichloro-4-(1-methyl-3-indolylcarboxyamide)phenyl]acetyl]-(4S)-methoxy-(2S)-pyrrolidinylmethoxy]cyclohexanecarboxylic acid via tert-butyl trans-[(4S)-Methoxy-(2S)-pyrrolidinylmethoxy]cyclohexanecarboxylate as a key intermediate. Chemical & pharmaceutical bulletin 20110101
Properties