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2296-23-3 | Benzonitrile, 4-hydroxy-3-iodo-
CAS No: 2296-23-3 Catalog No: AG002LP4 MDL No:MFCD11054826
Product Description
Catalog Number:
AG002LP4
Chemical Name:
Benzonitrile, 4-hydroxy-3-iodo-
CAS Number:
2296-23-3
Molecular Formula:
C7H4INO
Molecular Weight:
245.0172
MDL Number:
MFCD11054826
IUPAC Name:
4-hydroxy-3-iodobenzonitrile
InChI:
InChI=1S/C7H4INO/c8-6-3-5(4-9)1-2-7(6)10/h1-3,10H
InChI Key:
XAONDNGLTPLRKO-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(c(c1)I)O
Properties
Complexity:
162
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.934g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
245.019g/mol
Monoisotopic Mass:
244.934g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
44A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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