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16329-89-8 | Propanoic acid, 2,3-dichloro-2,3,3-trifluoro-, methyl ester
CAS No: 16329-89-8 Catalog No: AG001TZP MDL No:MFCD16620571
Product Description
Catalog Number:
AG001TZP
Chemical Name:
Propanoic acid, 2,3-dichloro-2,3,3-trifluoro-, methyl ester
CAS Number:
16329-89-8
Molecular Formula:
C4H3Cl2F3O2
Molecular Weight:
210.9666
MDL Number:
MFCD16620571
IUPAC Name:
methyl 2,3-dichloro-2,3,3-trifluoropropanoate
InChI:
InChI=1S/C4H3Cl2F3O2/c1-11-2(10)3(5,7)4(6,8)9/h1H3
InChI Key:
WPHTWHHNRDKENO-UHFFFAOYSA-N
SMILES:
COC(=O)C(C(Cl)(F)F)(Cl)F
Properties
Complexity:
175
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.946g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.961g/mol
Monoisotopic Mass:
209.946g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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