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Home Halogens 2,4-Dichlorobenzylamine

2,4-Dichlorobenzylamine

CAS No.:
95-00-1
Catalog Number:
AG0036R5
Molecular Formula:
C7H7Cl2N
Molecular Weight:
176.0432
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$32
- +
25g
98%
In Stock USA
United States
$113
- +
100g
98%
In Stock USA
United States
$325
- +
Product Description
Catalog Number:
AG0036R5
Chemical Name:
2,4-Dichlorobenzylamine
CAS Number:
95-00-1
Molecular Formula:
C7H7Cl2N
Molecular Weight:
176.0432
MDL Number:
MFCD00008109
IUPAC Name:
(2,4-dichlorophenyl)methanamine
InChI:
InChI=1S/C7H7Cl2N/c8-6-2-1-5(4-10)7(9)3-6/h1-3H,4,10H2
InChI Key:
SJUKJZSTBBSGHF-UHFFFAOYSA-N
SMILES:
NCc1ccc(cc1Cl)Cl
EC Number:
202-382-6
NSC Number:
25064
Properties
Complexity:
108  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.996g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
176.04g/mol
Monoisotopic Mass:
174.996g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Literature
Title Journal
Reductions of aliphatic and aromatic nitriles to primary amines with diisopropylaminoborane. The Journal of organic chemistry 20090306
Absolute asymmetric photocyclization of isopropylbenzophenone derivatives using a cocrystal approach involving single-crystal-to-single-crystal transformation. The Journal of organic chemistry 20050527
Benzylamines: synthesis and evaluation of antimycobacterial properties. Journal of medicinal chemistry 19840901
Properties