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2003-15-8 | Benzaldehyde, 3-(2-chloro-1,1,2-trifluoroethoxy)-
CAS No: 2003-15-8 Catalog No: AG002CO7 MDL No:MFCD07777137
Product Description
Catalog Number:
AG002CO7
Chemical Name:
Benzaldehyde, 3-(2-chloro-1,1,2-trifluoroethoxy)-
CAS Number:
2003-15-8
Molecular Formula:
C9H6ClF3O2
Molecular Weight:
238.5909
MDL Number:
MFCD07777137
IUPAC Name:
3-(2-chloro-1,1,2-trifluoroethoxy)benzaldehyde
InChI:
InChI=1S/C9H6ClF3O2/c10-8(11)9(12,13)15-7-3-1-2-6(4-7)5-14/h1-5,8H
InChI Key:
JSHMTEVWQBWYGH-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1)OC(C(Cl)F)(F)F
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.001g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.59g/mol
Monoisotopic Mass:
238.001g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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