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Home Nitriles 3,3-Diphenylpropionitrile

3,3-Diphenylpropionitrile

CAS No.:
2286-54-6
Catalog Number:
AG003IDU
Molecular Formula:
C15H13N
Molecular Weight:
207.2704
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$19
- +
5g
98%
In Stock USA
United States
$50
- +
10g
98%
In Stock USA
United States
$88
- +
25g
98%
In Stock USA
United States
$156
- +
100g
98%
In Stock USA
United States
$313
- +
Product Description
Catalog Number:
AG003IDU
Chemical Name:
3,3-Diphenylpropionitrile
CAS Number:
2286-54-6
Molecular Formula:
C15H13N
Molecular Weight:
207.2704
MDL Number:
MFCD00129747
IUPAC Name:
3,3-diphenylpropanenitrile
InChI:
InChI=1S/C15H13N/c16-12-11-15(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15H,11H2
InChI Key:
INERKLNEVAZSCI-UHFFFAOYSA-N
SMILES:
N#CCC(c1ccccc1)c1ccccc1
EC Number:
218-926-0
Properties
Complexity:
219  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.105g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
207.276g/mol
Monoisotopic Mass:
207.105g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties