Home Other Building Blocks P-Xylylenediamine

P-Xylylenediamine

CAS No.:
539-48-0
Catalog Number:
AG0035JL
Molecular Formula:
C8H12N2
Molecular Weight:
136.1943
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$13
- +
5g
95%
In Stock USA
United States
$19
- +
25g
95%
In Stock USA
United States
$44
- +
100g
95%
In Stock USA
United States
$119
- +
500g
95%
In Stock USA
United States
$475
- +
Product Description
Catalog Number:
AG0035JL
Chemical Name:
P-Xylylenediamine
CAS Number:
539-48-0
Molecular Formula:
C8H12N2
Molecular Weight:
136.1943
MDL Number:
MFCD00009821
IUPAC Name:
[4-(aminomethyl)phenyl]methanamine
InChI:
InChI=1S/C8H12N2/c9-5-7-1-2-8(6-10)4-3-7/h1-4H,5-6,9-10H2
InChI Key:
ISKQADXMHQSTHK-UHFFFAOYSA-N
SMILES:
NCc1ccc(cc1)CN
EC Number:
208-719-3
UNII:
FJD90IO4NH
Properties
Complexity:
73.3  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.1g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
136.198g/mol
Monoisotopic Mass:
136.1g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  
Literature
Title Journal
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1,5-Bis(2,5-dimethyl-1H-pyrrol-1-yl)naphthalene. Acta crystallographica. Section E, Structure reports online 20091101
2,2',5,5'-Tetra-methyl-1,1'-(hexane-1,6-di-yl)di-1H-pyrrole. Acta crystallographica. Section E, Structure reports online 20090701
1,4-Bis(3-pyridylmethyl-eneamino-meth-yl)benzene. Acta crystallographica. Section E, Structure reports online 20090201
1,4-Bis(2-pyridylmethyl-eneamino-meth-yl)benzene. Acta crystallographica. Section E, Structure reports online 20090201
24- and 26-membered macrocyclic diorganotin(IV) bis-dithiocarbamate complexes with N,N'-disubstituted 1,3- and 1,4-bis(aminomethyl)benzene and 1,1'-bis(aminomethyl)ferrocene as spacer groups. Inorganic chemistry 20081103
Hybrid host-guest complexes: directing the supramolecular structure through secondary host-guest interactions. Chemistry (Weinheim an der Bergstrasse, Germany) 20080101
Discovery of small molecule CXCR4 antagonists. Journal of medicinal chemistry 20071115
New efficient substrates for semicarbazide-sensitive amine oxidase/VAP-1 enzyme: analysis by SARs and computational docking. Journal of medicinal chemistry 20061019
Clays as a host matrix in the synthesis of organic macrocycles. Chemistry (Weinheim an der Bergstrasse, Germany) 20030818
Synchronized propagation mechanism for crystalline-state polymerization of p-xylylenediammonium disorbate. Journal of the American Chemical Society 20011212
Properties