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169044-98-8

169044-98-8 | 1H-Isoindol-1-one, 7-amino-2,3-dihydro-

CAS No: 169044-98-8 Catalog No: AG001YG6 MDL No:MFCD09396704

Product Description

Catalog Number:
AG001YG6
Chemical Name:
1H-Isoindol-1-one, 7-amino-2,3-dihydro-
CAS Number:
169044-98-8
Molecular Formula:
C8H8N2O
Molecular Weight:
148.1619
MDL Number:
MFCD09396704
IUPAC Name:
7-amino-2,3-dihydroisoindol-1-one
InChI:
InChI=1S/C8H8N2O/c9-6-3-1-2-5-4-10-8(11)7(5)6/h1-3H,4,9H2,(H,10,11)
InChI Key:
ZPJBSWJZELXZKA-UHFFFAOYSA-N
SMILES:
O=C1NCc2c1c(N)ccc2

Properties

Complexity:
181  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.064g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
148.165g/mol
Monoisotopic Mass:
148.064g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  

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