200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 1159825-57-6
1159825-57-6 | 1H-Isoindole-4-carbonitrile, 2,3-dihydro-, hydrochloride (1:1)
CAS No: 1159825-57-6 Catalog No: AG000HBL MDL No:MFCD10700139
Product Description
Catalog Number:
AG000HBL
Chemical Name:
1H-Isoindole-4-carbonitrile, 2,3-dihydro-, hydrochloride (1:1)
CAS Number:
1159825-57-6
Molecular Formula:
C9H9ClN2
Molecular Weight:
180.6342
MDL Number:
MFCD10700139
IUPAC Name:
2,3-dihydro-1H-isoindole-4-carbonitrile;hydrochloride
InChI:
InChI=1S/C9H8N2.ClH/c10-4-7-2-1-3-8-5-11-6-9(7)8;/h1-3,11H,5-6H2;1H
InChI Key:
XVJQMFRHWPSTDY-UHFFFAOYSA-N
SMILES:
N#Cc1cccc2c1CNC2.Cl
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.045g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
180.635g/mol
Monoisotopic Mass:
180.045g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
35.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.