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24544-09-0 | Benzenamine, 4-methyl-2,6-bis(1-methylethyl)-
CAS No: 24544-09-0 Catalog No: AG002OIB MDL No:
Product Description
Catalog Number:
AG002OIB
Chemical Name:
Benzenamine, 4-methyl-2,6-bis(1-methylethyl)-
CAS Number:
24544-09-0
Molecular Formula:
C13H21N
Molecular Weight:
191.3125
IUPAC Name:
4-methyl-2,6-di(propan-2-yl)aniline
InChI:
InChI=1S/C13H21N/c1-8(2)11-6-10(5)7-12(9(3)4)13(11)14/h6-9H,14H2,1-5H3
InChI Key:
BRUPWFGTGIGWFT-UHFFFAOYSA-N
SMILES:
Cc1cc(C(C)C)c(c(c1)C(C)C)N
Properties
Complexity:
156
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.167g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
191.318g/mol
Monoisotopic Mass:
191.167g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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