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128073-33-6 | Cyclopropanecarboxylic acid, 2,2-difluoro-1-methyl-
CAS No: 128073-33-6 Catalog No: AG000XR1 MDL No:MFCD07777163
Product Description
Catalog Number:
AG000XR1
Chemical Name:
Cyclopropanecarboxylic acid, 2,2-difluoro-1-methyl-
CAS Number:
128073-33-6
Molecular Formula:
C5H6F2O2
Molecular Weight:
136.0967
MDL Number:
MFCD07777163
IUPAC Name:
2,2-difluoro-1-methylcyclopropane-1-carboxylic acid
InChI:
InChI=1S/C5H6F2O2/c1-4(3(8)9)2-5(4,6)7/h2H2,1H3,(H,8,9)
InChI Key:
HLFLYOQLHYYNLT-UHFFFAOYSA-N
SMILES:
OC(=O)C1(C)CC1(F)F
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.034g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
136.098g/mol
Monoisotopic Mass:
136.034g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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