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1804906-40-8 | Phenol, 4-amino-3-bromo-2-fluoro-
CAS No: 1804906-40-8 Catalog No: AG00220O MDL No:MFCD28738819
Product Description
Catalog Number:
AG00220O
Chemical Name:
Phenol, 4-amino-3-bromo-2-fluoro-
CAS Number:
1804906-40-8
Molecular Formula:
C6H5BrFNO
Molecular Weight:
206.0124
MDL Number:
MFCD28738819
IUPAC Name:
4-amino-3-bromo-2-fluorophenol
InChI:
InChI=1S/C6H5BrFNO/c7-5-3(9)1-2-4(10)6(5)8/h1-2,10H,9H2
InChI Key:
NXWSTKAUJJWNIL-UHFFFAOYSA-N
SMILES:
Oc1ccc(c(c1F)Br)N
Properties
Complexity:
124
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.954g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
206.014g/mol
Monoisotopic Mass:
204.954g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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