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277756-46-4 | Cyclopropanecarboxylic acid, 1-(trifluoromethyl)-
CAS No: 277756-46-4 Catalog No: AG002UPV MDL No:MFCD03093070
Product Description
Catalog Number:
AG002UPV
Chemical Name:
Cyclopropanecarboxylic acid, 1-(trifluoromethyl)-
CAS Number:
277756-46-4
Molecular Formula:
C5H5F3O2
Molecular Weight:
154.0872
MDL Number:
MFCD03093070
IUPAC Name:
1-(trifluoromethyl)cyclopropane-1-carboxylic acid
InChI:
InChI=1S/C5H5F3O2/c6-5(7,8)4(1-2-4)3(9)10/h1-2H2,(H,9,10)
InChI Key:
SKCBKBCACWDALV-UHFFFAOYSA-N
SMILES:
OC(=O)C1(CC1)C(F)(F)F
Properties
Complexity:
168
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
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:
1.2
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