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29224-64-4

29224-64-4 | 1,4-Benzenediamine, N-[(1-methylethyl)phenyl]- (9CI)

CAS No: 29224-64-4 Catalog No: AG002XS7 MDL No:

Product Description

Catalog Number:
AG002XS7
Chemical Name:
1,4-Benzenediamine, N-[(1-methylethyl)phenyl]- (9CI)
CAS Number:
29224-64-4
Molecular Formula:
C15H18N2
Molecular Weight:
226.3168
IUPAC Name:
4-N-(2-propan-2-ylphenyl)benzene-1,4-diamine
InChI:
InChI=1S/C15H18N2/c1-11(2)14-5-3-4-6-15(14)17-13-9-7-12(16)8-10-13/h3-11,17H,16H2,1-2H3
InChI Key:
YEYRMHOEORZIII-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1)Nc1ccccc1C(C)C

Properties

Complexity:
219  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.147g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
226.323g/mol
Monoisotopic Mass:
226.147g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  

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