200,000+ products from a single source!
sales@angenechem.com
Home > Carboxes > 1138220-79-7
1138220-79-7 | 1H-Isoindol-1-one, 5-chloro-2,3-dihydro-6-methoxy-
CAS No: 1138220-79-7 Catalog No: AG0009SJ MDL No:
Product Description
Catalog Number:
AG0009SJ
Chemical Name:
1H-Isoindol-1-one, 5-chloro-2,3-dihydro-6-methoxy-
CAS Number:
1138220-79-7
Molecular Formula:
C9H8ClNO2
Molecular Weight:
197.6183
IUPAC Name:
5-chloro-6-methoxy-2,3-dihydroisoindol-1-one
InChI:
InChI=1S/C9H8ClNO2/c1-13-8-3-6-5(2-7(8)10)4-11-9(6)12/h2-3H,4H2,1H3,(H,11,12)
InChI Key:
MMBRLXRMVPEDCW-UHFFFAOYSA-N
SMILES:
COc1cc2C(=O)NCc2cc1Cl
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.024g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
197.618g/mol
Monoisotopic Mass:
197.024g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.