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138749-44-7

138749-44-7 | Benzenamine, 4,4'-(3,3,5-trimethylcyclohexylidene)bis-

CAS No: 138749-44-7 Catalog No: AG0019GU MDL No:

Product Description

Catalog Number:
AG0019GU
Chemical Name:
Benzenamine, 4,4'-(3,3,5-trimethylcyclohexylidene)bis-
CAS Number:
138749-44-7
Molecular Formula:
C21H28N2
Molecular Weight:
308.4604
IUPAC Name:
4-[1-(4-aminophenyl)-3,3,5-trimethylcyclohexyl]aniline
InChI:
InChI=1S/C21H28N2/c1-15-12-20(2,3)14-21(13-15,16-4-8-18(22)9-5-16)17-6-10-19(23)11-7-17/h4-11,15H,12-14,22-23H2,1-3H3
InChI Key:
BDFOELUHQOTNRK-UHFFFAOYSA-N
SMILES:
CC1CC(C)(C)CC(C1)(c1ccc(cc1)N)c1ccc(cc1)N

Properties

Complexity:
365  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
308.225g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
308.469g/mol
Monoisotopic Mass:
308.225g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7  

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