200,000+ products from a single source!
sales@angenechem.com
89611-44-9 | 1H-Isoindol-1-one, 2-(4-chlorophenyl)-2,3,4,5,6,7-hexahydro-3-imino-
CAS No: 89611-44-9 Catalog No: AG003WQH MDL No:
Product Description
Catalog Number:
AG003WQH
Chemical Name:
1H-Isoindol-1-one, 2-(4-chlorophenyl)-2,3,4,5,6,7-hexahydro-3-imino-
CAS Number:
89611-44-9
Molecular Formula:
C14H13ClN2O
Molecular Weight:
260.7188
IUPAC Name:
2-(4-chlorophenyl)-3-imino-4,5,6,7-tetrahydroisoindol-1-one
InChI:
InChI=1S/C14H13ClN2O/c15-9-5-7-10(8-6-9)17-13(16)11-3-1-2-4-12(11)14(17)18/h5-8,16H,1-4H2
InChI Key:
XQWXFZLDDAFDRT-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)N1C(=O)C2=C(C1=N)CCCC2
Properties
Complexity:
422
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.072g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
260.721g/mol
Monoisotopic Mass:
260.072g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
44.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.