Home Other Building Blocks 2-(4-hydroxy-4-methylcyclohexyl)propanoic acid

2-(4-hydroxy-4-methylcyclohexyl)propanoic acid

CAS No.:
1784308-51-5
Catalog Number:
AG01BFBR
Molecular Formula:
C10H18O3
Molecular Weight:
186.2481
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Product Description
Catalog Number:
AG01BFBR
Chemical Name:
2-(4-hydroxy-4-methylcyclohexyl)propanoic acid
CAS Number:
1784308-51-5
Molecular Formula:
C10H18O3
Molecular Weight:
186.2481
MDL Number:
MFCD24513252
IUPAC Name:
2-(4-hydroxy-4-methylcyclohexyl)propanoic acid
InChI:
InChI=1S/C10H18O3/c1-7(9(11)12)8-3-5-10(2,13)6-4-8/h7-8,13H,3-6H2,1-2H3,(H,11,12)
InChI Key:
YTLACJLUJODPDX-UHFFFAOYSA-N
SMILES:
OC(=O)C(C1CCC(CC1)(C)O)C
Properties
Complexity:
192  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.126g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
186.251g/mol
Monoisotopic Mass:
186.126g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties