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1379332-09-8 | 4-Chloro-2,5-difluorophenyl cyclopropyl ketone
CAS No: 1379332-09-8 Catalog No: AG01FA33 MDL No:
Product Description
Catalog Number:
AG01FA33
Chemical Name:
4-Chloro-2,5-difluorophenyl cyclopropyl ketone
CAS Number:
1379332-09-8
Molecular Formula:
C10H7ClF2O
Molecular Weight:
216.6118
IUPAC Name:
(4-chloro-2,5-difluorophenyl)-cyclopropylmethanone
InChI:
InChI=1S/C10H7ClF2O/c11-7-4-8(12)6(3-9(7)13)10(14)5-1-2-5/h3-5H,1-2H2
InChI Key:
KBXPTHSKMAWXGE-UHFFFAOYSA-N
SMILES:
O=C(c1cc(F)c(cc1F)Cl)C1CC1
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.015g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.612g/mol
Monoisotopic Mass:
216.015g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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