Home Nitriles 1-O-Tolylcyclopropanecarbonitrile

1-O-Tolylcyclopropanecarbonitrile

CAS No.:
124276-51-3
Catalog Number:
AG00HHM1
Molecular Formula:
C11H11N
Molecular Weight:
157.2117
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Product Description
Catalog Number:
AG00HHM1
Chemical Name:
1-O-Tolylcyclopropanecarbonitrile
CAS Number:
124276-51-3
Molecular Formula:
C11H11N
Molecular Weight:
157.2117
MDL Number:
MFCD07374411
IUPAC Name:
1-(2-methylphenyl)cyclopropane-1-carbonitrile
InChI:
InChI=1S/C11H11N/c1-9-4-2-3-5-10(9)11(8-12)6-7-11/h2-5H,6-7H2,1H3
InChI Key:
ZBRVAKYASUGIAX-UHFFFAOYSA-N
SMILES:
N#CC1(CC1)c1ccccc1C
Properties
Complexity:
218  
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:
1  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties