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Home Nitriles 3-(Ethyl(phenyl)amino)propanenitrile

3-(Ethyl(phenyl)amino)propanenitrile

CAS No.:
148-87-8
Catalog Number:
AG003JEM
Molecular Formula:
C11H14N2
Molecular Weight:
174.2423
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
25g
>98.0%(GC)(T)
1 week
United States
$94
- +
500g
>98.0%(GC)(T)
1 week
United States
$412
- +
Product Description
Catalog Number:
AG003JEM
Chemical Name:
3-(Ethyl(phenyl)amino)propanenitrile
CAS Number:
148-87-8
Molecular Formula:
C11H14N2
Molecular Weight:
174.2423
MDL Number:
MFCD00019858
IUPAC Name:
3-(N-ethylanilino)propanenitrile
InChI:
InChI=1S/C11H14N2/c1-2-13(10-6-9-12)11-7-4-3-5-8-11/h3-5,7-8H,2,6,10H2,1H3
InChI Key:
WYRNRZQRKCXPLA-UHFFFAOYSA-N
SMILES:
N#CCCN(c1ccccc1)CC
EC Number:
205-728-4
UNII:
465EKH3OG1
NSC Number:
81243
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.116g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
174.247g/mol
Monoisotopic Mass:
174.116g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Effect of cepea extract-heparin and allantoin mixture on epidural fibrosis in a rat hemilaminectomy model. Turkish neurosurgery 20091001
Properties