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170230-87-2

170230-87-2 | 4-Amino-3-ethylbenzonitrile

CAS No: 170230-87-2 Catalog No: AG003KPF MDL No:MFCD00041431

Product Description

Catalog Number:
AG003KPF
Chemical Name:
4-Amino-3-ethylbenzonitrile
CAS Number:
170230-87-2
Molecular Formula:
C9H10N2
Molecular Weight:
146.1891
MDL Number:
MFCD00041431
IUPAC Name:
4-amino-3-ethylbenzonitrile
InChI:
InChI=1S/C9H10N2/c1-2-8-5-7(6-10)3-4-9(8)11/h3-5H,2,11H2,1H3
InChI Key:
YOHLABDNVQLZIA-UHFFFAOYSA-N
SMILES:
CCc1cc(C#N)ccc1N

Properties

Complexity:
168  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.084g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
146.193g/mol
Monoisotopic Mass:
146.084g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

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