Home Carboxys 1,2-dimethylcyclopropanecarboxylic acid

1,2-dimethylcyclopropanecarboxylic acid

CAS No.:
594846-52-3
Catalog Number:
AG01DTIY
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01DTIY
Chemical Name:
1,2-dimethylcyclopropanecarboxylic acid
CAS Number:
594846-52-3
MDL Number:
MFCD19228404
IUPAC Name:
1,2-dimethylcyclopropane-1-carboxylic acid
InChI:
InChI=1S/C6H10O2/c1-4-3-6(4,2)5(7)8/h4H,3H2,1-2H3,(H,7,8)
InChI Key:
MMEAVAVRZYNYFB-UHFFFAOYSA-N
Properties
Complexity:
131  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
114.068g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
114.144g/mol
Monoisotopic Mass:
114.068g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Literature
Title Journal
Screening, cultivation, and biocatalytic performance of Rhodococcus boritolerans FW815 with strong 2,2-dimethylcyclopropanecarbonitrile hydratase activity. Journal of industrial microbiology & biotechnology 20120301
(E)-2-(2-Chloro-3,3,3-trifluoro-prop-1-en-yl)-N-(2,4-dimethyl-phen-yl)-3,3-dimethyl-cyclo-propane-1-carboxamide. Acta crystallographica. Section E, Structure reports online 20090701
(E)-3-(2-Chloro-3,3,3-trifluoro-prop-1-en-yl)-2,2-dimethyl-N-p-tolyl-cyclo-propane-carboxamide. Acta crystallographica. Section E, Structure reports online 20080201
Properties