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Home > Bromides > 1805936-02-0
1805936-02-0 | Benzonitrile, 4-bromo-5-fluoro-2-hydroxy-
CAS No: 1805936-02-0 Catalog No: AG00224U MDL No:MFCD25459713
Product Description
Catalog Number:
AG00224U
Chemical Name:
Benzonitrile, 4-bromo-5-fluoro-2-hydroxy-
CAS Number:
1805936-02-0
Molecular Formula:
C7H3BrFNO
Molecular Weight:
216.0072
MDL Number:
MFCD25459713
IUPAC Name:
4-bromo-5-fluoro-2-hydroxybenzonitrile
InChI:
InChI=1S/C7H3BrFNO/c8-5-2-7(11)4(3-10)1-6(5)9/h1-2,11H
InChI Key:
XBBNMZLXTQRDQA-UHFFFAOYSA-N
SMILES:
N#Cc1cc(F)c(cc1O)Br
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.938g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
216.009g/mol
Monoisotopic Mass:
214.938g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
44A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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