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20292-28-8 | Acetic acid, 2-[(3-chloro[1,1'-biphenyl]-4-yl)oxy]-
CAS No: 20292-28-8 Catalog No: AG0028JZ MDL No:MFCD06655657
Product Description
Catalog Number:
AG0028JZ
Chemical Name:
Acetic acid, 2-[(3-chloro[1,1'-biphenyl]-4-yl)oxy]-
CAS Number:
20292-28-8
Molecular Formula:
C14H11ClO3
Molecular Weight:
262.6883
MDL Number:
MFCD06655657
IUPAC Name:
2-(2-chloro-4-phenylphenoxy)acetic acid
InChI:
InChI=1S/C14H11ClO3/c15-12-8-11(10-4-2-1-3-5-10)6-7-13(12)18-9-14(16)17/h1-8H,9H2,(H,16,17)
InChI Key:
UQRLYDDCHNEFAP-UHFFFAOYSA-N
SMILES:
OC(=O)COc1ccc(cc1Cl)c1ccccc1
Properties
Complexity:
276
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.04g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
262.689g/mol
Monoisotopic Mass:
262.04g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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