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Home > Nitro Compounds > 147644-06-2
147644-06-2 | 1-(2-Nitro-phenyl)-cyclopropanecarbonitrile
CAS No: 147644-06-2 Catalog No: AG00JOJF MDL No:
Product Description
Catalog Number:
AG00JOJF
Chemical Name:
1-(2-Nitro-phenyl)-cyclopropanecarbonitrile
CAS Number:
147644-06-2
Molecular Formula:
C10H8N2O2
Molecular Weight:
188.1827
IUPAC Name:
1-(2-nitrophenyl)cyclopropane-1-carbonitrile
InChI:
InChI=1S/C10H8N2O2/c11-7-10(5-6-10)8-3-1-2-4-9(8)12(13)14/h1-4H,5-6H2
InChI Key:
YMEJRUFFWQQOBD-UHFFFAOYSA-N
SMILES:
N#CC1(CC1)c1ccccc1[N+](=O)[O-]
Properties
Complexity:
295
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.059g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.186g/mol
Monoisotopic Mass:
188.059g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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