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114341-15-0 | Benzoyl chloride, 3-(1,3-dihydro-1-oxo-2H-isoindol-2-yl)-
CAS No: 114341-15-0 Catalog No: AG000B42 MDL No:
Product Description
Catalog Number:
AG000B42
Chemical Name:
Benzoyl chloride, 3-(1,3-dihydro-1-oxo-2H-isoindol-2-yl)-
CAS Number:
114341-15-0
Molecular Formula:
C15H10ClNO2
Molecular Weight:
271.6984
IUPAC Name:
3-(3-oxo-1H-isoindol-2-yl)benzoyl chloride
InChI:
InChI=1S/C15H10ClNO2/c16-14(18)10-5-3-6-12(8-10)17-9-11-4-1-2-7-13(11)15(17)19/h1-8H,9H2
InChI Key:
FCEFHJTYGHLWFZ-UHFFFAOYSA-N
SMILES:
ClC(=O)c1cccc(c1)N1Cc2c(C1=O)cccc2
Properties
Complexity:
384
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.04g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
271.7g/mol
Monoisotopic Mass:
271.04g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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