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24789-52-4 | Benzonitrile, 4-(2,4-dichlorophenoxy)-
CAS No: 24789-52-4 Catalog No: AG002PF6 MDL No:MFCD01815091
Product Description
Catalog Number:
AG002PF6
Chemical Name:
Benzonitrile, 4-(2,4-dichlorophenoxy)-
CAS Number:
24789-52-4
Molecular Formula:
C13H7Cl2NO
Molecular Weight:
264.1068
MDL Number:
MFCD01815091
IUPAC Name:
4-(2,4-dichlorophenoxy)benzonitrile
InChI:
InChI=1S/C13H7Cl2NO/c14-10-3-6-13(12(15)7-10)17-11-4-1-9(8-16)2-5-11/h1-7H
InChI Key:
ZZAIAUSRLITERQ-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1)Oc1ccc(cc1Cl)Cl
Properties
Complexity:
293
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.99g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
264.105g/mol
Monoisotopic Mass:
262.99g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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