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19262-20-5 | Benzene, (1,2,2-trimethylpropyl)-
CAS No: 19262-20-5 Catalog No: AG002G4W MDL No:
Product Description
Catalog Number:
AG002G4W
Chemical Name:
Benzene, (1,2,2-trimethylpropyl)-
CAS Number:
19262-20-5
Molecular Formula:
C12H18
Molecular Weight:
162.2713
IUPAC Name:
3,3-dimethylbutan-2-ylbenzene
InChI:
InChI=1S/C12H18/c1-10(12(2,3)4)11-8-6-5-7-9-11/h5-10H,1-4H3
InChI Key:
UYOAOYYUSXVILM-UHFFFAOYSA-N
SMILES:
CC(C(C)(C)C)c1ccccc1
Properties
Complexity:
124
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.141g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
162.276g/mol
Monoisotopic Mass:
162.141g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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