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1373233-13-6 | 2-Propanone, 1-(2,5-dichloro-3-pyridinyl)-
CAS No: 1373233-13-6 Catalog No: AG00135J MDL No:MFCD22192542
Product Description
Catalog Number:
AG00135J
Chemical Name:
2-Propanone, 1-(2,5-dichloro-3-pyridinyl)-
CAS Number:
1373233-13-6
Molecular Formula:
C8H7Cl2NO
Molecular Weight:
204.0533
MDL Number:
MFCD22192542
IUPAC Name:
1-(2,5-dichloropyridin-3-yl)propan-2-one
InChI:
InChI=1S/C8H7Cl2NO/c1-5(12)2-6-3-7(9)4-11-8(6)10/h3-4H,2H2,1H3
InChI Key:
QPQJNQHWLHPQML-UHFFFAOYSA-N
SMILES:
CC(=O)Cc1cc(Cl)cnc1Cl
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.99g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.05g/mol
Monoisotopic Mass:
202.99g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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