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128146-96-3 | Cyclobutanecarbonyl chloride, 2-chloro-2,3,3-trifluoro-1-methyl-
CAS No: 128146-96-3 Catalog No: AG000XTN MDL No:
Product Description
Catalog Number:
AG000XTN
Chemical Name:
Cyclobutanecarbonyl chloride, 2-chloro-2,3,3-trifluoro-1-methyl-
CAS Number:
128146-96-3
Molecular Formula:
C6H5Cl2F3O
Molecular Weight:
221.0045
IUPAC Name:
2-chloro-2,3,3-trifluoro-1-methylcyclobutane-1-carbonyl chloride
InChI:
InChI=1S/C6H5Cl2F3O/c1-4(3(7)12)2-5(9,10)6(4,8)11/h2H2,1H3
InChI Key:
TTZYIQSSXPOPGU-UHFFFAOYSA-N
SMILES:
ClC(=O)C1(C)CC(C1(F)Cl)(F)F
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.967g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221g/mol
Monoisotopic Mass:
219.967g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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