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Home Carboxys 1-Cyclohexene-1-carboxylic acid, 4-(1-methylethenyl)-, (4S)-

1-Cyclohexene-1-carboxylic acid, 4-(1-methylethenyl)-, (4S)-

CAS No.:
23635-14-5
Catalog Number:
AG002NZA
Molecular Formula:
C10H14O2
Molecular Weight:
166.2170
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Product Description
Catalog Number:
AG002NZA
Chemical Name:
1-Cyclohexene-1-carboxylic acid, 4-(1-methylethenyl)-, (4S)-
CAS Number:
23635-14-5
Molecular Formula:
C10H14O2
Molecular Weight:
166.2170
MDL Number:
MFCD00062539
IUPAC Name:
(4S)-4-prop-1-en-2-ylcyclohexene-1-carboxylic acid
InChI:
InChI=1S/C10H14O2/c1-7(2)8-3-5-9(6-4-8)10(11)12/h5,8H,1,3-4,6H2,2H3,(H,11,12)/t8-/m1/s1
InChI Key:
CDSMSBUVCWHORP-MRVPVSSYSA-N
SMILES:
CC(=C)[C@H]1CCC(=CC1)C(=O)O
Properties
Complexity:
238  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
166.099g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
166.22g/mol
Monoisotopic Mass:
166.099g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Literature
Title Journal
Exploration of natural compounds as sources of new bifunctional scaffolds targeting cholinesterases and beta amyloid aggregation: the case of chelerythrine. Bioorganic & medicinal chemistry 20121115
Influence of the active compounds of Perilla frutescens leaves on lipid membranes. Journal of natural products 20120224
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties