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1049030-29-6 | 4-(4-tert-Butylphenyl)-2-chloro-1-butene
CAS No: 1049030-29-6 Catalog No: AG01FBRJ MDL No:
Product Description
Catalog Number:
AG01FBRJ
Chemical Name:
4-(4-tert-Butylphenyl)-2-chloro-1-butene
CAS Number:
1049030-29-6
Molecular Formula:
C14H19Cl
Molecular Weight:
222.7537
IUPAC Name:
1-tert-butyl-4-(3-chlorobut-3-enyl)benzene
InChI:
InChI=1S/C14H19Cl/c1-11(15)5-6-12-7-9-13(10-8-12)14(2,3)4/h7-10H,1,5-6H2,2-4H3
InChI Key:
RIZQQPUJKPQEBY-UHFFFAOYSA-N
SMILES:
ClC(=C)CCc1ccc(cc1)C(C)(C)C
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.118g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.756g/mol
Monoisotopic Mass:
222.118g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4
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