200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 114041-13-3
114041-13-3 | 1H-Isoindole, 2,3-dihydro-5,6-dimethoxy-2-methyl-, hydrochloride (9CI)
CAS No: 114041-13-3 Catalog No: AG000ADA MDL No:
Product Description
Catalog Number:
AG000ADA
Chemical Name:
1H-Isoindole, 2,3-dihydro-5,6-dimethoxy-2-methyl-, hydrochloride (9CI)
CAS Number:
114041-13-3
Molecular Formula:
C11H16ClNO2
Molecular Weight:
229.7032
IUPAC Name:
5,6-dimethoxy-2-methyl-1,3-dihydroisoindole;hydrochloride
InChI:
InChI=1S/C11H15NO2.ClH/c1-12-6-8-4-10(13-2)11(14-3)5-9(8)7-12;/h4-5H,6-7H2,1-3H3;1H
InChI Key:
LXFVBCXERQVIRD-UHFFFAOYSA-N
SMILES:
COc1cc2CN(Cc2cc1OC)C.Cl
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.087g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
229.704g/mol
Monoisotopic Mass:
229.087g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
21.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.