Home Halogens 4-(chloromethyl)-1,2-dihydroisoquinolin-1-one

4-(chloromethyl)-1,2-dihydroisoquinolin-1-one

CAS No.:
2092777-38-1
Catalog Number:
AG01BTJ2
Molecular Formula:
C10H8ClNO
Molecular Weight:
193.6296
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Product Description
Catalog Number:
AG01BTJ2
Chemical Name:
4-(chloromethyl)-1,2-dihydroisoquinolin-1-one
CAS Number:
2092777-38-1
Molecular Formula:
C10H8ClNO
Molecular Weight:
193.6296
MDL Number:
MFCD30730558
IUPAC Name:
4-(chloromethyl)-2H-isoquinolin-1-one
InChI:
InChI=1S/C10H8ClNO/c11-5-7-6-12-10(13)9-4-2-1-3-8(7)9/h1-4,6H,5H2,(H,12,13)
InChI Key:
APHVZTLNMHVBKB-UHFFFAOYSA-N
SMILES:
ClCc1c[nH]c(=O)c2c1cccc2
Properties
Complexity:
249  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.029g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
193.63g/mol
Monoisotopic Mass:
193.029g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties