Home Carboxys (+/-)-cis-2-(Trifluoromethyl)cyclopropanecarboxylic acid

(+/-)-cis-2-(Trifluoromethyl)cyclopropanecarboxylic acid

CAS No.:
1258652-18-4
Catalog Number:
AG00HIQ6
Molecular Formula:
C5H5F3O2
Molecular Weight:
154.0872
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Product Description
Catalog Number:
AG00HIQ6
Chemical Name:
(+/-)-cis-2-(Trifluoromethyl)cyclopropanecarboxylic acid
CAS Number:
1258652-18-4
Molecular Formula:
C5H5F3O2
Molecular Weight:
154.0872
MDL Number:
MFCD17977173
IUPAC Name:
(1S,2R)-2-(trifluoromethyl)cyclopropane-1-carboxylic acid
InChI:
InChI=1S/C5H5F3O2/c6-5(7,8)3-1-2(3)4(9)10/h2-3H,1H2,(H,9,10)/t2-,3+/m0/s1
InChI Key:
GSNLYQDUCHEFFQ-STHAYSLISA-N
SMILES:
OC(=O)[C@H]1C[C@H]1C(F)(F)F
Properties
Complexity:
163  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
154.024g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
154.088g/mol
Monoisotopic Mass:
154.024g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties