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1261472-63-2 | Phenol, 3-chloro-4,5-difluoro-
CAS No: 1261472-63-2 Catalog No: AG000RS0 MDL No:MFCD18415631
Product Description
Catalog Number:
AG000RS0
Chemical Name:
Phenol, 3-chloro-4,5-difluoro-
CAS Number:
1261472-63-2
Molecular Formula:
C6H3ClF2O
Molecular Weight:
164.5372
MDL Number:
MFCD18415631
IUPAC Name:
3-chloro-4,5-difluorophenol
InChI:
InChI=1S/C6H3ClF2O/c7-4-1-3(10)2-5(8)6(4)9/h1-2,10H
InChI Key:
BEZZBNYGPCGUKO-UHFFFAOYSA-N
SMILES:
Oc1cc(F)c(c(c1)Cl)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:
163.984g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
164.536g/mol
Monoisotopic Mass:
163.984g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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