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14411-75-7 | Benzene, 1,3-dimethyl-2-(1-methylethyl)-
CAS No: 14411-75-7 Catalog No: AG001IYV MDL No:
Product Description
Catalog Number:
AG001IYV
Chemical Name:
Benzene, 1,3-dimethyl-2-(1-methylethyl)-
CAS Number:
14411-75-7
Molecular Formula:
C11H16
Molecular Weight:
148.2447
IUPAC Name:
1,3-dimethyl-2-propan-2-ylbenzene
InChI:
InChI=1S/C11H16/c1-8(2)11-9(3)6-5-7-10(11)4/h5-8H,1-4H3
InChI Key:
IVCIQLTVLDOHKA-UHFFFAOYSA-N
SMILES:
CC(c1c(C)cccc1C)C
Properties
Complexity:
105
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.125g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
148.249g/mol
Monoisotopic Mass:
148.125g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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