Home Nitriles 2-(4-aminoquinazolin-2-yl)acetonitrile

2-(4-aminoquinazolin-2-yl)acetonitrile

CAS No.:
868760-92-3
Catalog Number:
AG019MET
Molecular Formula:
C10H8N4
Molecular Weight:
184.1973
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Product Description
Catalog Number:
AG019MET
Chemical Name:
2-(4-aminoquinazolin-2-yl)acetonitrile
CAS Number:
868760-92-3
Molecular Formula:
C10H8N4
Molecular Weight:
184.1973
MDL Number:
MFCD10686810
IUPAC Name:
2-(4-aminoquinazolin-2-yl)acetonitrile
InChI:
InChI=1S/C10H8N4/c11-6-5-9-13-8-4-2-1-3-7(8)10(12)14-9/h1-4H,5H2,(H2,12,13,14)
InChI Key:
KEPKITZVQRXULY-UHFFFAOYSA-N
SMILES:
N#CCc1nc2ccccc2c(n1)N
Properties
Complexity:
244  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.075g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
184.202g/mol
Monoisotopic Mass:
184.075g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties