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88875-60-9 | Benzeneacetic acid,3,4-dichloro-a-phenyl-
CAS No: 88875-60-9 Catalog No: AG0049MK MDL No:MFCD01631957
Product Description
Catalog Number:
AG0049MK
Chemical Name:
Benzeneacetic acid,3,4-dichloro-a-phenyl-
CAS Number:
88875-60-9
Molecular Formula:
C14H10Cl2O2
Molecular Weight:
281.1340
MDL Number:
MFCD01631957
IUPAC Name:
2-(3,4-dichlorophenyl)-2-phenylacetic acid
InChI:
InChI=1S/C14H10Cl2O2/c15-11-7-6-10(8-12(11)16)13(14(17)18)9-4-2-1-3-5-9/h1-8,13H,(H,17,18)
InChI Key:
XHOSLHVZDULGLF-UHFFFAOYSA-N
SMILES:
OC(=O)C(c1ccc(c(c1)Cl)Cl)c1ccccc1
Properties
Complexity:
290
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.006g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
281.132g/mol
Monoisotopic Mass:
280.006g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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