Home Nitriles 1-[(oxiran-2-yl)methyl]cyclopropane-1-carbonitrile

1-[(oxiran-2-yl)methyl]cyclopropane-1-carbonitrile

CAS No.:
1799542-61-2
Catalog Number:
AG01BVBH
Molecular Formula:
C7H9NO
Molecular Weight:
123.1525
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Product Description
Catalog Number:
AG01BVBH
Chemical Name:
1-[(oxiran-2-yl)methyl]cyclopropane-1-carbonitrile
CAS Number:
1799542-61-2
Molecular Formula:
C7H9NO
Molecular Weight:
123.1525
MDL Number:
MFCD30486582
IUPAC Name:
1-(oxiran-2-ylmethyl)cyclopropane-1-carbonitrile
InChI:
InChI=1S/C7H9NO/c8-5-7(1-2-7)3-6-4-9-6/h6H,1-4H2
InChI Key:
BUEBRHPDALUUME-UHFFFAOYSA-N
SMILES:
N#CC1(CC1)CC1OC1
Properties
Complexity:
175  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
123.068g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
123.155g/mol
Monoisotopic Mass:
123.068g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
36.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties