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10219-31-5 | Benzenamine, N-(1,1-dimethylethyl)-4-methyl-
CAS No: 10219-31-5 Catalog No: AG0006UU MDL No:
Product Description
Catalog Number:
AG0006UU
Chemical Name:
Benzenamine, N-(1,1-dimethylethyl)-4-methyl-
CAS Number:
10219-31-5
Molecular Formula:
C11H17N
Molecular Weight:
163.2594
IUPAC Name:
N-tert-butyl-4-methylaniline
InChI:
InChI=1S/C11H17N/c1-9-5-7-10(8-6-9)12-11(2,3)4/h5-8,12H,1-4H3
InChI Key:
XVOOKSRPDMBTAI-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)NC(C)(C)C
Properties
Complexity:
126
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.136g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
163.264g/mol
Monoisotopic Mass:
163.136g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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