Home Other Building Blocks 1-tert-butyl-4-(prop-1-en-2-yl)benzene

1-tert-butyl-4-(prop-1-en-2-yl)benzene

CAS No.:
25163-88-6
Catalog Number:
AG01ANE3
Molecular Formula:
C13H18
Molecular Weight:
174.2820
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Product Description
Catalog Number:
AG01ANE3
Chemical Name:
1-tert-butyl-4-(prop-1-en-2-yl)benzene
CAS Number:
25163-88-6
Molecular Formula:
C13H18
Molecular Weight:
174.2820
MDL Number:
MFCD00027695
IUPAC Name:
1-tert-butyl-4-prop-1-en-2-ylbenzene
InChI:
InChI=1S/C13H18/c1-10(2)11-6-8-12(9-7-11)13(3,4)5/h6-9H,1H2,2-5H3
InChI Key:
IHKJXCKVKGBGSQ-UHFFFAOYSA-N
SMILES:
CC(=C)c1ccc(cc1)C(C)(C)C
Properties
Complexity:
175  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.141g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
174.287g/mol
Monoisotopic Mass:
174.141g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5  
Properties