Home Other Building Blocks 1-(4-NITROPHENYL)CYCLOBUTANECARBONITRILE

1-(4-NITROPHENYL)CYCLOBUTANECARBONITRILE

CAS No.:
1236409-69-0
Catalog Number:
AG00A1H8
Molecular Formula:
C11H10N2O2
Molecular Weight:
202.2093
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Product Description
Catalog Number:
AG00A1H8
Chemical Name:
1-(4-NITROPHENYL)CYCLOBUTANECARBONITRILE
CAS Number:
1236409-69-0
Molecular Formula:
C11H10N2O2
Molecular Weight:
202.2093
MDL Number:
MFCD11036725
IUPAC Name:
1-(4-nitrophenyl)cyclobutane-1-carbonitrile
InChI:
InChI=1S/C11H10N2O2/c12-8-11(6-1-7-11)9-2-4-10(5-3-9)13(14)15/h2-5H,1,6-7H2
InChI Key:
JHOHTGSVQASAEI-UHFFFAOYSA-N
SMILES:
N#CC1(CCC1)c1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
300  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.074g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.213g/mol
Monoisotopic Mass:
202.074g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties