Home Nitriles 2-(1-phenylcyclopropyl)acetonitrile

2-(1-phenylcyclopropyl)acetonitrile

CAS No.:
149488-95-9
Catalog Number:
AG01B6J9
Molecular Formula:
C11H11N
Molecular Weight:
157.2117
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Product Description
Catalog Number:
AG01B6J9
Chemical Name:
2-(1-phenylcyclopropyl)acetonitrile
CAS Number:
149488-95-9
Molecular Formula:
C11H11N
Molecular Weight:
157.2117
MDL Number:
MFCD22570378
IUPAC Name:
2-(1-phenylcyclopropyl)acetonitrile
InChI:
InChI=1S/C11H11N/c12-9-8-11(6-7-11)10-4-2-1-3-5-10/h1-5H,6-8H2
InChI Key:
ZDCGDVYPXDJWKA-UHFFFAOYSA-N
SMILES:
N#CCC1(CC1)c1ccccc1
Properties
Complexity:
200  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.089g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
157.216g/mol
Monoisotopic Mass:
157.089g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties