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740807-00-5 | Piperazine, 1-(4-chloro-2-fluoro-5-methoxyphenyl)-
CAS No: 740807-00-5 Catalog No: AG005HM9 MDL No:
Product Description
Catalog Number:
AG005HM9
Chemical Name:
Piperazine, 1-(4-chloro-2-fluoro-5-methoxyphenyl)-
CAS Number:
740807-00-5
Molecular Formula:
C11H14ClFN2O
Molecular Weight:
244.6931
IUPAC Name:
1-(4-chloro-2-fluoro-5-methoxyphenyl)piperazine
InChI:
InChI=1S/C11H14ClFN2O/c1-16-11-7-10(9(13)6-8(11)12)15-4-2-14-3-5-15/h6-7,14H,2-5H2,1H3
InChI Key:
QIFYJMPMJLJMLD-UHFFFAOYSA-N
SMILES:
COc1cc(N2CCNCC2)c(cc1Cl)F
Properties
Complexity:
226
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.078g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
244.694g/mol
Monoisotopic Mass:
244.078g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
24.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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