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779-14-6 | 1-(Chloro(phenyl);methyl);-4-methylbenzene
CAS No: 779-14-6 Catalog No: AG005EHY MDL No:
Product Description
Catalog Number:
AG005EHY
Chemical Name:
1-(Chloro(phenyl);methyl);-4-methylbenzene
CAS Number:
779-14-6
Molecular Formula:
C14H13Cl
Molecular Weight:
216.7060
IUPAC Name:
1-[chloro(phenyl)methyl]-4-methylbenzene
InChI:
InChI=1S/C14H13Cl/c1-11-7-9-13(10-8-11)14(15)12-5-3-2-4-6-12/h2-10,14H,1H3
InChI Key:
RRNSKPOVJIKVNB-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)C(c1ccccc1)Cl
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.071g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.708g/mol
Monoisotopic Mass:
216.071g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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