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113512-71-3 | Phenol, 5-amino-2,4-difluoro-
CAS No: 113512-71-3 Catalog No: AG0008U7 MDL No:MFCD04973718
Product Description
Catalog Number:
AG0008U7
Chemical Name:
Phenol, 5-amino-2,4-difluoro-
CAS Number:
113512-71-3
Molecular Formula:
C6H5F2NO
Molecular Weight:
145.1068
MDL Number:
MFCD04973718
IUPAC Name:
5-amino-2,4-difluorophenol
InChI:
InChI=1S/C6H5F2NO/c7-3-1-4(8)6(10)2-5(3)9/h1-2,10H,9H2
InChI Key:
CXADAFQCFSVRGN-UHFFFAOYSA-N
SMILES:
Nc1cc(O)c(cc1F)F
Properties
Complexity:
122
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
145.034g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
145.109g/mol
Monoisotopic Mass:
145.034g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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