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401495-67-8 | 4-(4-Methylpiperazin-1-yl)benzoyl chloride
CAS No: 401495-67-8 Catalog No: AG01FOIA MDL No:
Product Description
Catalog Number:
AG01FOIA
Chemical Name:
4-(4-Methylpiperazin-1-yl)benzoyl chloride
CAS Number:
401495-67-8
IUPAC Name:
4-(4-methylpiperazin-1-yl)benzoyl chloride
InChI:
InChI=1S/C12H15ClN2O/c1-14-6-8-15(9-7-14)11-4-2-10(3-5-11)12(13)16/h2-5H,6-9H2,1H3
InChI Key:
QUHFMFPTVRJESL-UHFFFAOYSA-N
Properties
Complexity:
243
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.087g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.715g/mol
Monoisotopic Mass:
238.087g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
23.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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