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163811-28-7 | N-Benzoyl-2-(difluoromethyl)pyrrole
CAS No: 163811-28-7 Catalog No: AG01FOG2 MDL No:
Product Description
Catalog Number:
AG01FOG2
Chemical Name:
N-Benzoyl-2-(difluoromethyl)pyrrole
CAS Number:
163811-28-7
IUPAC Name:
[2-(difluoromethyl)pyrrol-1-yl]-phenylmethanone
InChI:
InChI=1S/C12H9F2NO/c13-11(14)10-7-4-8-15(10)12(16)9-5-2-1-3-6-9/h1-8,11H
InChI Key:
MTGNPQCKYUXXEZ-UHFFFAOYSA-N
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.065g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.207g/mol
Monoisotopic Mass:
221.065g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
22A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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