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17609-80-2 | Phenol, 4-amino-3-chloro-
CAS No: 17609-80-2 Catalog No: AG0021FK MDL No:MFCD00801116
Product Description
Catalog Number:
AG0021FK
Chemical Name:
Phenol, 4-amino-3-chloro-
CAS Number:
17609-80-2
Molecular Formula:
C6H6ClNO
Molecular Weight:
143.5709
MDL Number:
MFCD00801116
IUPAC Name:
4-amino-3-chlorophenol
InChI:
InChI=1S/C6H6ClNO/c7-5-3-4(9)1-2-6(5)8/h1-3,9H,8H2
InChI Key:
PNLPXABQLXSICH-UHFFFAOYSA-N
SMILES:
Oc1ccc(c(c1)Cl)N
EC Number:
241-583-3
Properties
Complexity:
99.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
143.014g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
143.57g/mol
Monoisotopic Mass:
143.014g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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