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4062-60-6

4062-60-6 | N,N'-Di-tert-butylethylenediamine

CAS No: 4062-60-6 Catalog No: AG0037IC MDL No:MFCD00014996

Product Description

Catalog Number:
AG0037IC
Chemical Name:
N,N'-Di-tert-butylethylenediamine
CAS Number:
4062-60-6
Molecular Formula:
C10H24N2
Molecular Weight:
172.3110
MDL Number:
MFCD00014996
IUPAC Name:
N,N'-ditert-butylethane-1,2-diamine
InChI:
InChI=1S/C10H24N2/c1-9(2,3)11-7-8-12-10(4,5)6/h11-12H,7-8H2,1-6H3
InChI Key:
KGHYGBGIWLNFAV-UHFFFAOYSA-N
SMILES:
CC(NCCNC(C)(C)C)(C)C
EC Number:
223-769-6
UNII:
6WAI8U5V0W

Properties

Complexity:
101  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.194g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
172.316g/mol
Monoisotopic Mass:
172.194g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
24.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  

Literature

Title Journal
Reaction coordinate of a functional model of tyrosinase: spectroscopic and computational characterization. Journal of the American Chemical Society 20090513
Theoretical study of the hydroxylation of phenolates by the Cu(2)O (2)(N,N'-dimethylethylenediamine) (2) (2+) complex. Journal of biological inorganic chemistry : JBIC : a publication of the Society of Biological Inorganic Chemistry 20090201
Syntheses, structures, luminescence and electrochemistry of benzene- and biphenyl-centered bis- and tris-1,3,2-diazaboroles and -1,3,2-diazaborolidines. Dalton transactions (Cambridge, England : 2003) 20060507
Stable optically pure phosphino(silyl)carbenes: reagents for highly enantioselective cyclopropanation reactions. Chemistry (Weinheim an der Bergstrasse, Germany) 20040419
A stabilized mu-eta(2):eta(2) peroxodicopper(II) complex with a secondary diamine ligand and its tyrosinase-like reactivity. Journal of the American Chemical Society 20020814
Structure-activity studies leading to ethambutol, a new type of antituberculous compound. Annals of the New York Academy of Sciences 19660420

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