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138083-58-6 | Benzene, 1,4-dimethyl-2-(phenylethyl)- (9CI)
CAS No: 138083-58-6 Catalog No: AG0017ZK MDL No:
Product Description
Catalog Number:
AG0017ZK
Chemical Name:
Benzene, 1,4-dimethyl-2-(phenylethyl)- (9CI)
CAS Number:
138083-58-6
Molecular Formula:
C16H18
Molecular Weight:
210.3141
IUPAC Name:
1,4-dimethyl-2-(2-phenylethyl)benzene
InChI:
InChI=1S/C16H18/c1-13-8-9-14(2)16(12-13)11-10-15-6-4-3-5-7-15/h3-9,12H,10-11H2,1-2H3
InChI Key:
LROLLPFSQKOCPV-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1)CCc1ccccc1)C
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.141g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.32g/mol
Monoisotopic Mass:
210.141g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
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