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1243444-99-6 | Benzonitrile, 3-amino-5-hydroxy-
CAS No: 1243444-99-6 Catalog No: AG000LWI MDL No:MFCD16999146
Product Description
Catalog Number:
AG000LWI
Chemical Name:
Benzonitrile, 3-amino-5-hydroxy-
CAS Number:
1243444-99-6
Molecular Formula:
C7H6N2O
Molecular Weight:
134.1353
MDL Number:
MFCD16999146
IUPAC Name:
3-amino-5-hydroxybenzonitrile
InChI:
InChI=1S/C7H6N2O/c8-4-5-1-6(9)3-7(10)2-5/h1-3,10H,9H2
InChI Key:
FCYINOGGOHJKBT-UHFFFAOYSA-N
SMILES:
N#Cc1cc(N)cc(c1)O
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
134.048g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
134.138g/mol
Monoisotopic Mass:
134.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
70A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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