Home Carboxys Cyclohexanecarboxylic acid, 4-hydroxy-1-methyl-, trans-

Cyclohexanecarboxylic acid, 4-hydroxy-1-methyl-, trans-

CAS No.:
76657-91-5
Catalog Number:
AG01DXYB
Molecular Formula:
C8H14O3
Molecular Weight:
158.1950
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Product Description
Catalog Number:
AG01DXYB
Chemical Name:
Cyclohexanecarboxylic acid, 4-hydroxy-1-methyl-, trans-
CAS Number:
76657-91-5
Molecular Formula:
C8H14O3
Molecular Weight:
158.1950
MDL Number:
MFCD30803003
IUPAC Name:
4-hydroxy-1-methylcyclohexane-1-carboxylic acid
InChI:
InChI=1S/C8H14O3/c1-8(7(10)11)4-2-6(9)3-5-8/h6,9H,2-5H2,1H3,(H,10,11)
InChI Key:
NRJADRDKYOBCKH-UHFFFAOYSA-N
SMILES:
O[C@@H]1CC[C@@](CC1)(C)C(=O)O
Properties
Complexity:
157  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.094g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
158.197g/mol
Monoisotopic Mass:
158.094g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties