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141994-71-0 | Phenol, 3-[(2,4-dichlorophenyl)methoxy]-
CAS No: 141994-71-0 Catalog No: AG001HIC MDL No:
Product Description
Catalog Number:
AG001HIC
Chemical Name:
Phenol, 3-[(2,4-dichlorophenyl)methoxy]-
CAS Number:
141994-71-0
Molecular Formula:
C13H10Cl2O2
Molecular Weight:
269.1233
IUPAC Name:
3-[(2,4-dichlorophenyl)methoxy]phenol
InChI:
InChI=1S/C13H10Cl2O2/c14-10-5-4-9(13(15)6-10)8-17-12-3-1-2-11(16)7-12/h1-7,16H,8H2
InChI Key:
NQNUHXOSXIGJRX-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)Cl)COc1cccc(c1)O
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.006g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
269.121g/mol
Monoisotopic Mass:
268.006g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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