Home Nitriles 2-(4,5-dihydro-1H-imidazol-2-yl)acetonitrile

2-(4,5-dihydro-1H-imidazol-2-yl)acetonitrile

CAS No.:
23539-64-2
Catalog Number:
AG01A46B
Molecular Formula:
C5H7N3
Molecular Weight:
109.1292
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Product Description
Catalog Number:
AG01A46B
Chemical Name:
2-(4,5-dihydro-1H-imidazol-2-yl)acetonitrile
CAS Number:
23539-64-2
Molecular Formula:
C5H7N3
Molecular Weight:
109.1292
MDL Number:
MFCD23144258
IUPAC Name:
2-(4,5-dihydro-1H-imidazol-2-yl)acetonitrile
InChI:
InChI=1S/C5H7N3/c6-2-1-5-7-3-4-8-5/h1,3-4H2,(H,7,8)
InChI Key:
CWDFRBNFCCNDKB-UHFFFAOYSA-N
SMILES:
N#CCC1=NCCN1
Properties
Complexity:
150  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
109.064g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
109.132g/mol
Monoisotopic Mass:
109.064g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
48.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9  
Properties